MOL2NET: FROM MOLECULES TO NETWORKS (PROC. BOOK), 2018, Vol. 3, 679 pp.

Welcome from the Chairs

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Welcome from the Conference Chair

In fact, this is an International Conference Series to Foster Interdisciplinary Collaborations in Sciences with emphasis on Experimental Chemistry (all branches), Materials Science, Nanotechnology, Life Sciences, Medicine, and Healthcare, along with Data Analysis, Computer Sciences, Bioinformatics, Systems Biology, and Complex Networks Sciences.

The Scientific Headquarters (HQs) of this conference series are in the Faculty of Science and Technology, University of Basque Country (UPV/EHU), Biscay. However, the idea of this multidisciplinary conference emerged from the melting pot formed as the result of multiple collaborations of professors from many centers worldwide.

Locally, the founders and strongest supporters of the conference are professors endowed by IKERBASQUE, Basque Foundation for Sciences, professors from the two departments Department of Organic Chemistry I and Department of Organic Chemistry II of the University of Basque Country (UPV/EHU), and professors from the Department of Computer Sciences of the University of Coruña (UDC).

In addition, professors / researchers from the Center for the Study of Biological Complexity of the Virginia Commonwealth University (VCU), USA, the Natural Resources Research Institute, of the University of Minnesota, USA, and many other institutions are also founders and supporters of this conference, please see full committees lists.

Participation Modalities (Online and In person)

The conference has two main participation modalities. The fisrt is the online participation by submission and publication of your written communication, slide presentation, and/or video conference totally online, and free of charge (see the 3 general sections).

The second modallity is the online and/or in person (face-to-face) participation in some of the workshops we organize in different universities worldwide (see workshops section)

Publication of all communications will be online via the platform SciForum of the Editorial Molecular Diversity Preservation International (MDPI), with HQ in Basel, Switzerland, and Beijing -Wuhan, China.

This year the second edition of MOL2NET is planed to be held from 2017-Feb-15 to 2017-Nov-30 (including interactive discussions, posts, comments, questions, and answers about papers in the online platform Sciforum). However, the online submission platform is open and the publication of communications will be asap upon acceptance, all the year. For more details, see Schedule & Program page and to submit a communication use the Submission link. Remember, these are the dates for the online conference and not for the face-to-face workshops associated to the conference.

MOL2NET Past Editions

MOL2NET-01, the first edition of this conference series, was held in Dec 2015. This first conference attracted more than 100 papers and 300+ authors and/or committee members representing 30+ universities of 20+ countries. Some of the world top universities and centers represented in the lists of committee members and/or authors were: Harvard Medical School, Boston, USA; Stanford School of Medicine, USA; Virginia Commonwealth University (VCU), USA; University of Minnesota Duluth, MN, USA; Conservatoire National des Arts et Métiers, CNAM París, France; University of Pennsylvania, USA; Miller School of Medicine, University of Miami, USA; EMBL-EBI European Bioinformatics Institute, Cambridge, UK; CAS Chinese Academy of Science, China; ZJU Zhejiang University, China.

MOL2NET-02, the 2nd edition of this conference series, was held in Dec 2016. This 2nd conference published 150 communications of 400+ authors 30+ universities of 20+ countries. Some of the world top universities and centers represented in the lists of committee members and/or authors were:
Harvard Medical School, Boston, USA; Stanford School of Medicine, USA; Virginia Commonwealth University (VCU), USA; University of Minnesota Duluth, MN, USA; Conservatoire National des Arts et Métiers, CNAM París, France; University of Pennsylvania, USA; Miami Dade Collegue (MDC), USA; EMBL-EBI European Bioinformatics Institute, Cambridge, UK; CAS Chinese Academy of Science, China; ZJU Zhejiang University, China.

‪Associated Workshops (In person participation)

MOL2NET International Conferences Series on Multidisciplinary Sciences is a scientific conference that runs totally online at the SciForum platform promoted by the editorial of the Molecular Diversity Preservation Institute (MDPI), Basel, Switzerland. https://sciforum.net/conference/mol2net-02. Consequently, no physical presence is needed saving traveling costs.

However multiple workshops associated to the conference run in person (face-to-face) at their organizing universities. This year our conference is planing to host some of these workshops. The participants in these workshops will be allowed also to participate and comment online in our platform including cross-section comments.

We welcome proposals for organization of workshops in the different universities. Please, do not hesitate to contact conference chairperson and/or scientific committee presidents. Some of the workshops organized last year were:

SRI-08 The 8th Annual Undergraduate Summer Research Symposium of Saint Thomas University, Miami, USA, Sept, 2016. Symposium of the Summer Research Institute (SRI), HQ Saint Thomas University (STU), Miami, FL, USA. Workshop supported by STE-TRAC Miami Dade College (MDC) grant. Topics: Multidisciplinary sciences, Applied physics, Environmental Sciences, Bio-molecular Sciences, etc. Chairpersons: Prof. David Quesada and Prof. Humberto Gonzalez-Diaz (Online Publication). (38 communications)

‪IWMEDIC-04, IV International Workshop on Medical Imaging, Medical Coding, and Clinical Data Analysis of University of Coruña (UDC). Was held presentially at the University Hospital Complex of A Coruña (June, 20, 2016), Hospital Médico Quirúrgico San Rafael (June, 21,2016), and Faculty of Computer Sciences, UDC (June, 20-22, 2016). Topics: Medical Imaging, Medical Informatics, Bioinformatics, etc. Chairperson: Prof. Alejandro Pazos. (30 communications)

‪UFIQOSYC-01‬, Workshop was held at the Department of Organic Chemistry II, University of Basque Country UPV/EHU. Topics: Organic Chemistry, Chemical Catalysis, Organic Synthesis. Chairpersons: Prof. Esther Lete, Prof. Esther Domínguez Pérez, and Prof. Jose Luis Vicario. (17 communications)

BMEICB-02 Second Bioinformatics Meeting of The School of Bioinformatics Engineering, University of Talca, Talca, Chile, (Oct, 13-14, 2016). Topics: Bioinformatics, Informatics Engineering, Medical Informatics, Chemoinformatics, etc. Chairpersons: Prof. Gabriel Nuñez and Prof. Julio Caballero. (MOL2NET Contact). (12 communications)

SUIWCS-01, Soochow University International Workshop Series on Computer Sciences. The SUIWCS-01 workshop was held in person at the the School of Computer Science and Technology of Soochow University (SUDA), PCR, China (Nov, 2016). Topics: Machine Learning, Reinforcement Learning, Bioinformatics, Medical Informatics, Chemoinformatics, etc. Chairpersons: Prof. Quan Liu, Assist. Prof. Xiaoke Zhou (MOL2NET Contact). (12 communications)

MDPI JCR Journals Special Issues

In parallel, the members of committees and/or authors are encouraged to edit special issues for different journals of the editorial MDPI (http://www.mdpi.com/). See, as example, the special issue on the International Journal of Molecular Sciences (IJMS), IF = 3.257), with 18 papers in total including papers from the conference, link: Special Issue on Data Analysis in Molecular Sciences. In order to send a proposal of associated workshop and/or special issue contact the chairperson of the conference and UPV/EHU Ikerbasque Professor Prof. H. González-Díaz .

MOL2NET People, Media Channels, and Social Networks

We are uploading flyers and promotional videos (in different languages) to the MOL2NET accounts in different social networks such as: GOOGLE+ account with +50000 viewers; FACEBOOK group with +10000 followers; and TWITTER account @mol2net. In addition, we have uploaded topic-specific pages with lists of contacts of people related to the conference. In this page you can find people with research interests focused on one specific area such as Organic Chemistry, Computational Chemistry, Materials or Nanoscience, etc. In this sense, to contact people related to all areas of Chemistry you may visit [Section 01], but to contact people related to Organic Chemistry & Medicinal Chemistry specifically (organic synthesis, catalysis, drug discovery, etc.) you can visit also the page Organic Chemistry People, as well as [Section 08].

NOTES for participants

The MOL2NET conference is Totally Online; no physical presence is needed saving traveling costs. We accept experimental works, theoretical works, or experimental-theoretic works in the areas mentioned. Proceedings will be Published Online, Open Access, and Totally Free of Charges (no cost). Please, see the following instructions: (1) Read call for papers [Link], (2) Read [Instructions to Authors] and download template .doc file MOL2NET 2016 Microsoft Word template file, (3) Submit short communications (2-3 pages), reviews, papers, or videos: [Link]. For details about in person (face-to-face) participation on associated workshops contact the respective members of the local committees.

THANK YOU FOR YOUR SUPPORT!!!

Sincerely yours

MOL2NET Chairman

Prof. González-Díaz H., IKERBASQUE Professor, Email: [email protected]
(1) Department of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Spain.
(2) IKERBASQUE, Basque Foundation for Science , 48011, Bilbao, Biscay, Spain.
ORCID: https://orcid.org/0000-0002-9392-2797

MOL2NET Sponsors

Conference Chairs

Humbert Gonzalez-Diaz

Humbert González-Díaz

[Not defined]

Humbert Gonzalez-Diaz

University of Basque Country (UPV/EHU)

Sessions

00. Editorial & Proceedings Book
01. Chemistry (All Areas), Soft Matter Physics, Pharmaceutical Sciences, Polymer, and Nanosciences
02. OMICs, Biotechnology, Bioinformatics, Neurosciences, and Biomedical Engineering
03. Computational Sciences, Statistics, Artificial Intelligence, Complex Networks, Machine Learning, and Big Data
04. SRI-09: 9th Summer Research Institute Symposium, STU-MDC, Miami, USA, 2017
05. WCUCW-01 West Coast University Capstone Workshop, WCU, Miami, USA, 2017
06. USINEWS-01; US-IN-EU Worldwide Science Workshop Series, UMN, Duluth, USA, 2017.
07. IWIMSM-01: Iberoamerican Workshop on Modelization and Simulation, UCV, Valencia, Spain, 2017
08. LAWSCI-01: Challenges in Law, Technology, Life, and Social Sciences, UPV/EHU, Bilbao, Spain, 2017
09. SIUSCI-01: San Ignacio University Sciences Workshop, SIU, Miami,USA, 2017
10. EJIBCE-01; Meeting of Young Researchers in Structural Computational Biology, UC, Coimbra, Portugal, 2017
11. EHUDW-01: First EHU-DELFIN Programme Workshop, UPV/EHU, Bilbao, Spain, 2017
12. MODEC-02: Workshop on Natural Products and Agro-Industrial Procesess in Amazon, UEA, Puyo, Ecuador, 2017
13. WRSAMC-02: Workshop in Medicinal Chemistry, UFPB, Paraiba, Brasil, 2017
14. UCHCEUW-14: 14th UCH-CEU Workshop on Multidisciplinary Sciences, UCH, Valencia, Spain, 2017

Instructions for Authors

Notes to Authors

The MOL2NET conference runs both online (general sections) and/or in person (associated workshops); no physical presence is needed for online participation saving traveling costs. We accept experimental works, theoretical works, or experimental-theoretic works in the areas mentioned. Proceedings will be Published Online, Open Access, and Totally Free of Charges (no cost). For details about in person (face-to-face) participation on associated workshops contact the respective members of the local committees.

Before to submit your communication recommend to download and use the template file below to write your communication; we strongly recommend you to read carefully the following notes to participants about publication model, copyright, authors responsibilities, etc.

Before to submit your work be aware that the works published here belongs to two main modalities preliminary communications or comments on previous works.

Preliminary communications are not post-print journal papers. In this sense, committee and/or external reviewers check only scope and apparent scientific soundness. They have the same editorial process than for an online Preprint service. Therefore, all works receive doi number and are indexed in databases (GoogleScholar, Publons, etc.).The works may receive also comments from registered participants (public post-publication review). The authors are encouraged to submit their works to a peer-reviewed scientific journals of MDPI or other editorials during or after finalization of the conference, as per SciForum copyright rules.

Research Highlights are comments on previous works, they are short notes devoted to comment about the more interesting points, update some topics, highlights, etc. of works previously published by the authors or other groups. In this case, committee and/or external reviewers check also only scope and apparent scientific soundness. The works may receive also comments from registered participants (public post-publication review).

In any case, it is the duty and responsibility of the authors solely, to ensure the veracity of the contents, checking similarity to other works, and carry out a proper citation of previous works. The committee is not responsible of this previous aspects in this publishing modality. In this sense, we strongly recommend the authors to use online text-similarity checking services to avoid any form of plagiarism or copyright violation. The authors may be requested to modify the communication (re-write their texts) in the case that high similarity is detected and reported to the committee. In these cases, the manuscript could be put on standby or withdrawn temporarily until the authors re-submit the proper version. The authors are also allowed to submit short reviews, comments, letters, or discussions of papers already published if they guarantee sufficient difference to previous public contents.

mol2net_03_MOL2NET_2017_template.docx

List of accepted submissions (174)

Id	Title	Authors
sciforum-016259	*"In silico" estimation of encapsulation-induced pK_a shifts in drugs.* Diogo Reis, Miguel Machuqueiro, Diogo Vila-Viçosa Submitted: 15 Dec 2017 Abstract: Show Abstract	Diogo Reis, Miguel Machuqueiro, Diogo Vila-Viçosa	Show Abstract
Molecular machines have recently been associated with the development of molecular carriers to enhance drug properties, such as solubility or bioavailability. One possible approach is the drug encapsulation by a host molecule, such as cucurbituril (CB) rings, modifying the environment of the guest molecule. CB rings are able to encapsulate guest molecules providing a hydrophobic cavity and several carbonyl groups that stabilize cationic hosts that interact with this region. This will result in significant pK_a shifts for drugs with titrable (cationic) groups that can be exploited in order to improve drug bioavailability, whether by enhancing their solubility, stabilizing their active form or by protecting them against external agents. This approach can be used for medical targeting, such as cancer therapy, by designing carriers that deliver guest molecules at specific conditions, knowing the target properties. Computational tools are a powerful way to help the rational design of CB-guest complexes. In particular, the stochastic titrations constant-pH MD (CpHMD) method allows a molecular dynamics simulation to have the pH value as an external parameter and, consequently, obtain full titration curves and pK_a values. The main goal here is to develop a strategy to model benzimidazole (BZ) pK_a shifts, our «proof-of-concept» molecule, and then extrapolate this process to other host-guest complexes. BZ has a well-known shift of ~3.5 pK_a units when encapsulated by a CB ring and, with the refinement and fine tuning of this process, it is possible to elucidate the molecular details of these host-guest interactions. We acknowledge financial support from FCT through project UID/MULTI/00612/2013 and grant SFRH/BPD/110491/2015.
sciforum-015470	*4,6,6-trimethylbicyclo [3.1.1] hept-3-ene: Analysis of the Inhibitory Effect of Monoterpere on Pseudomonas aeruginosa* Strain** Ticiane Farias, Letícia de Eduardo, Siluana Ferreira, Zilka Lima, Sávio Ferreira Submitted: 14 Nov 2017 Abstract: Show Abstract	Ticiane Farias, Letícia de Eduardo, Siluana Ferreira, Zilka Lima, Sávio Ferreira	Show Abstract
Pseudomonas aeruginosa is a ubiquitous gram-negative non-fermentative bacterial species that exhibits natural resistance to some antibiotics and antiseptics, in addition to having a high expression of virulence factors, being responsible for causing, mainly, opportunistic infections in the hospital environment. It affects the respiratory tract causing about 80% of hospital pneumonias, being able to reach skin, soft tissues, eyes, ears, bones and the urinary tract. The treatment of nosocomial infections caused by P. aeruginosa is based on several classes of drugs, such as: Cephalosporins, Carbapenems, Aminoglycosides, among others. However, studies point to the existence of multiresistant species, including reserve drugs, such as imipenem, thus generating a public health problem. In addition, this year the World Health Organization has released a list of ten challenging multi-resistant microorganisms that require new antibiotics, and secondly the species Pseudomonas aeruginosa carbapenem-resistant. Given this panorama of bacteria resistant to multiple commercially available antibiotics, it is necessary to study new compounds with antibacterial activity. As a possibility to combat bacterial infections, the action of a natural product, the positive enantiomer of 4,6,6-trimethylbicyclo [3.1.1] hept-3-ene, also known as (+) - α-pinene, before the Pseudomonas aeruginosa strain ATCC 27853, using methodologies standardized by the Manual Clinical and Laboratory Standards Institute. Minimum Inhibitory Concentration (MIC), Minimum Bactericidal Concentration, and Nature Classification of Compound Effect were determined according to CBM/MIC ratio. The (+) - α-pinene was dissolved in 1% Tween 80, 5% DMSO and distilled water. In broth microdilution, the MIC was determined for the P. aeruginosa strain, at a concentration of 40 μL/mL, being characterized as bacteriostatic and the concentration 4 times higher than MIC was demonstrated to be bactericidal. This experiment made it possible to observe the action of the phytoconstituent on the species of Pseudomonas aeruginosa, emphasizing the need for permanent studies to determine the mechanism of action and toxicity of (+) - a - pinene allowing its future use against opportunistic infections caused by Pseudomonas aeruginosa.
sciforum-016034	A Combined Approach of Ligand-based and Structure-based Virtual Screening to select structures with potential antichagasic activity from SISTEMATX sesquiterpene lactones database. Chonny Herrera-Acevedo, Luciana Scotti, Marcus Tullius Scotti Submitted: 04 Dec 2017 Abstract: Show Abstract	Chonny Herrera-Acevedo, Luciana Scotti, Marcus Tullius Scotti	Show Abstract
Chagas disease is an endemic disease caused by Trypanosoma cruzi, which affects more than eight million people, mostly in the Americas. A search for new treatments is necessary to control and eliminate this disease. Sesquiterpene lactones (SLs) are an interesting group of secondary metabolites characteristic of Asteraceae that have presented a wide range of biological activities. From the ChEMBL database, we selected a diverse set of 4,452, 1,635 and 1,322 structures with tested activity against the three T. cruzi parasitic forms, amastigote, trypomastigotes and epimastigote, respectively, to create random forest (RF) models with an accuracy of greater than 74 % for cross-validation and test sets. Afterwards, a ligand-based virtual screen of the entire SLs of Asteraceae database stored in SistematX (1,306 structures) was performed. In addition, a structure-based virtual screen was also performed for the same set of SLs using molecular docking. Finally, using an approach combining ligand-based and structure-based virtual screening along with the equations proposed in this study to normalize the probability scores, we verified potentially active compounds and established a possible mechanism of action.
sciforum-014363	A Simple Method to Classification α-Amylase and α-Glucosidase Inhibitors Using LDA and Decision Trees Karel Diéguez-Santana, Oscar Rivera-Borroto, Amilkar Puris Caceres, Gerardo Casañola-Martin Submitted: 26 Sep 2017 Abstract: Show Abstract	Karel Diéguez-Santana, Oscar Rivera-Borroto, Amilkar Puris Caceres, Gerardo Casañola-Martin	Show Abstract
In this report are used two datasets involving the main antidiabetic enzymes targets α-amylase and α-glucosidase. The prediction of α-amylase and α -glucosidase inhibitory activity as Antidiabetic Agents is carried out using LDA and classification trees (CT). A large data set of 640 compounds for α-amylase and 1546 compounds in the case of α-glucosidase are selected to develop the tree model. In the case of CT-J48 have the better classification model performances for both targets with values above 80- 90% for the training and prediction sets, correspondingly. The best model shows an accuracy higher than 95% for training set; the model was also validated using 10-fold cross-validation procedure and through a test set achieving accuracies values of 85.32% and 86.80%, correspondingly. The main descriptors that influence the inhibitory activity of the antidiabetic enzymes are interpreted. Additionally, the obtained model is compared with other approaches previously published in the international literature showing better or goodness results. Finally, we can say that, the present results provided a double target approach for increasing the estimation of antidiabetic chemicals identification aimed by double-way workflow in virtual screenings pipelines
sciforum-015871	A brief account of the search for peptide vaccines Subhas Basak, Ashesh Nandy Submitted: 26 Nov 2017 Abstract: Show Abstract	Subhas Basak, Ashesh Nandy	Show Abstract
An increasing trend of viral diseases have led to search for faster response systems for preventives and therapeutics. While traditional vaccinations have led to spectacular successes against smallpox and polio viruses, the need for rapid response to new viral epidemics, like in the case of Ebola and Zika viruses, has called for new ways of tackling such infections. The fact that viral diseases are notoriously difficult to control, due primarily to their nature of fast mutational changes leading to growth of new strains and development of strains resistant to prevailing medications, adds an extra layer of complexity to the task. Peptide vaccines provide one means of responding to the epidemics. Since they are developed based on the viral sequences and focused on the antigenic sites, peptide vaccines are amenable to rational design paradigms. The first such vaccine for the canine parvovirus was developed in the 1980s and many peptide vaccines against human viral diseases are under different stages of phase trials. While production of such vaccines can be fast and cost-effective, and there are several issues still to be resolved, peptide vaccines are expected to play a major role in the future. In this very bried review we recount current status and some of the different approaches to design of peptide vaccines.

Full List

List of Authors (488)

Yuri Abad Cordero

Fatma ABDMOULEH

Wemerson Afonso

Prakhar Agarwal

Santiago Aguiar-Novillo

Rahul Aher

Saud Ahmad

Jorge Alba

Ana Albert

Kaire Alcivar M.

Reinaldo Alemán

Hadia Almahli

José Almeida

Reynerio Álvarez Borroto

Ander Alvaro

Jans Alzate Morales

Pravin Ambure

Marco Andino

Oleg Andreev

Gerardo Antón-Fos

Erik Aostri

Vicente ARAN

Rodrigo Araújo

Pablo Ernesto Arias

Ruth Arias Gutiérrez

Honor Advisory Committee

Prof. James J. Chou

Department Biological Chemistry & Molecular

Pharmacology (BCMP), Harvard Medical School,

Boston, MA 02115, USA.

Prof. Jerzy Leszczynski

Department of Chemistry and Biochemistry, Interdisciplinary Center for Nanotoxicity (ICN), Jackson State University (JSU), USA.

Prof. Dr. Peter Langer

Full Professor (C4) of Organic Chemistry,

Vice Director Institute of Chemistry,

University of Rostock,

Head of the Department of Organic Chemistry.

Universität Rostock Institut für Chemie Abteilung

für Organische Chemie Albert-Einstein-Straße

3a 18059 Rostock.

Prof. Ernesto Estrada Roger

Department of Mathematics and Statistics,

Chair in Complexity Sciences,

Institute of Complexity Systems,

University of Strathclyde Glasgow, G1 1XQ, UK.

Editor-in-Chief of Journal of Complex Networks,

Oxford Academic Press.

Prof. Victor M. Preciado

Raj and Neera Singh Term Assistant Professor

Electrical and Systems Engineering (ESE),

Penn Engineering, University of Pennsilvania, USA.

Prof. Daniel Graham

Professor of Chemistry,

Loyola University of Chicago (LUC), USA.

Prof. Roberto I. Vazquez Padron

Ph.D, D.M., Research Associate Prof. of Surgery,

Molecular and Cellular Pharmacology,

Miller School of Medicine,

University of Miami, USA.

Prof. Kuo-Chen Chou

Gordon Life Science Institute, Belmont, MA, USA,

Center of Excellence in Genomic Medicine Research

(CEGMR), King Abdulaziz University,

Jeddah 21589, Saudi Arabia.

Prof. Jesús Jimenez Barbero

Ikerbasque Professor, Scientific Director of

Center for Cooperative Research in Biosciences

(CICBiogune), Bizkaia.

President of Royal Society of Chemistry of Spain

Prof. José María Pitarke

Prof. of Condesed Matter Physics, UPV/EHU,

Director of Nanomaterials Cooperative

Research Center (CICNanoGune),

Tolosa Hiribidea, 76, E-20018

Donostia – San Sebastian, Gipuzkoa.

Prof. Luis M Liz-Marzán

Ikerbasque Senior Professor,

Scientific Director of Center for

Cooperative Research in Biomaterials

(CICbiomaGUNE), Gipuzkoa

Prof. C.M. Romeo Casabona

Full Professor of Law, University of Basque Country

(UPV/EHU), Bilbao, Bizkaia.

Director of Law & Human Genome Inter

Universitary Chair, UPV/EHU-University of Deusto,

Bilbao, Bizkaia.

Prof. Alejandro Pazos

Ph.D., M.D., Chair and Director of

Department of Computer Sciences,

University of Coruña (UDC), Coruña, Spain

Prof. Yiyu Cheng

Director of Pharmaceutical Informatics Institute,

Zhejiang University (ZJU), China

Dr. Françoise Dumas

Directrice de recherche

CNRS, Université Paris-Sud,

BioCIS, Faculty of Pharmacy

Châtenay-Malabry, Île-de-France, France

Prof. Roberto Todeschini

Professor of Chemometrics,

Department of Environmental Sciences

University of Milano-Bicocca, Milano, Italy.

Prof. Miguel A. Gutierrez Ortiz

Department of Chemical Engineering,

University of Basque Country (UPV/EHU),

Campus Bizkaia, Leioa, Sarriena w/n, Bizkaia.

Prof. Fernando Martín Sánchez

Assistant Professor of Healthcare Policy and Research, Weill Cornell Medical College, New York, USA.

Professorial Honorary Fellow, Melbourne Medical School, The University of Melbourne, Australia.
(2016 - 2020)

Thank you for your support!!!

MOL2NET Chairman

Scientific Committee (Abroad)

Presidents of the Abroad Scientific Committee

President of Scientific Committee (Polymers & Materials Sciences)

Assist. Prof. Bakhtiyor Rasulev

Department of Coatings and Polymeric Material,

North Dakota State University (NDSU), Fargo, USA

President of Scientific Committee (Computational Chemistry and Nanosciences)

Prof. Natalia D.S. Cordeiro

Professor of Computational Chemistry

Department of Chemistry and Biochemistry,

Faculty of Sciences, University of Porto,

Porto, Portugal

President of Scientific Committee (Experimental Chemistry)

Dr. Maité Sylla

(Assoc. Professor)

Conservatoire National des Arts et Métiers (CNAM), Equipe de Chimie Moléculaire, Laboratoire de Chimie Moléculaire, Génie des Procédés Chimiques et énergétiques, CMGPCE, EA7341. Bureau 31.4, Accès 31, 4ème étage 2 rue Conté 75003 Paris, France. [email protected]

President of Scientific Committee (Physics, Environmental, and Atmospheric Sciences)

Dr. David Quesada

Associate Professor of Physics,

School of Science, Technology,

and Engineering Management

St. Thomas University, Miami, FL, USA

(Chair of SRI08 Workshop, Miami, USA)

[Honor Committee]

[Scientific Committee (Abroad)]

[Scientific Committee (Local)]

Abroad Scientific Committee (North America)

Prof. Maykel Cruz-Monteagudo, FCT Fellow, Univ. of Porto; Consultant, Univ. of Miami, Full Prof. West Coast University, FL, USA.

Prof. James Robert Green, Assoc. Prof., Dept. of Systems and Computer Engineering, Carleton University, Ottawa, Canada.

Prof. William H Bisson, Assist. Prof.. Dept. of Environ. & Molecular Toxicology, Oregon State University, OR, USA.

Dr. Jose A. Seoane, Research Associate, Stanford Cancer Institute, Stanford University, Stanford, CA, USA.

Dr. Natalia Sizochenko, ICN, Dept. of Chemistry and Biochemistry, Jackson State University, Jackson, MS, USA.

Dr. Vanessa Aguiar-Pulido, Research Associate, Weill Cornell Medical College, New York City, NY, USA.

Dr. Robersy Sánchez, Eberly College of Science, Huck Institutes of the Life Sciences, The Pennsylvania State University, USA.

Dr. Marta G. Lete, Texas A&M Health and Science Center, Dept. of Molecular and Cellular Medicine, College Station, TX, USA.

Dr. Santiago Vilar Varela, Research Associate, Department of Systems Biology, Columbia University, USA.

Dr. Advait Apte, Scientific Programmer, Department of Biology, City College of New York, New York, NY, USA.

Dr. Shameer Khader, Philips Healthcare, Philips Research Americas, 2 Canal Park Cambridge, MA, USA.

Dr. Diana María Herrera-Ibatá, Research Associate, Kansas State University, Manhattan, KS, USA.

Dr. Gerardo Casañola-Martín, Visiting Fellow, Dept. of Systems and Computer Engineering, Carleton University, Canada.

Members of Scientific Committee (Europe)

Prof. Ricardo Grau-Crespo, Lecturer Department of Chemistry, University of Reading, Reading, United Kingdom.

Prof. Adriana Chilin, Department of Pharmaceutical and Pharmacological Sciences, University of Padova, Padova, Italy.

Prof. Fernanda Borges, Department of Chemistry and Biochemistry, University of Porto, Portugal.

Dr. Hector M. Díaz-Albiter, Wellcome Trust Centre for Molecular Parasitology, University of Glasgow , United Kingdom.

Dr. Yasset Perez-Riverol, EMBL-EBI, Wellcome Trust Genome Campus, Hinxton, Cambridge, United Kingdom.

Dr. Luisa Di Paola, Department of Engineering, Università Campus Bio-Medico, Rome, Italy.

Dr. Agnieszka Gajewicz, Assist. Prof., Faculty of Chemistry, University of Gdansk, Gdansk, Poland.

Dr. Hugo Gutiérrez-de-Terán, Department of Cell and Molecular Biology, Uppsala University, Sweden.

Dr. Irina Moreira, FCT Investigator, University of Coimbra, and Marie Curie Fellow at Utrecht University, Netherlands.

Dr. Giovanni Marzaro, Department of Pharmaceutical and Pharmacological Sciences, Padua University, Padua, Italy.

Dr. Riccardo Concu, FCT Post-doctoral Researcher, University of Porto, Porto, Portugal.

Porf. Igor Iosifovich Baskin, M.V. Lomonosov Moscow State University, Moscow, Russia.

Members of Scientific Committee (Other Regions)

Prof. Kazuhiro Takemoto, Assoc. Prof., Dept. of Bioscience and Bioinformatics, Kyushu Institute of Technology, Japan.

Prof. Kunal Roy, Department of Pharmaceutical Technology, Jadavpur University, Kolkata, India.

Prof. Yovani Marrero-Ponce, University San Francisco de Quito, Cumbayá, Quito, Ecuador.

Prof. Carolina Horta Andrade, Universidade Federal de Goias, Setor Leste Universitario, Goiania, Brazil.

Prof. Marcus T Scotti, Universidade Federal da Paraíba, Campus IV, Paraíba, Brazil.

Dr. Anuraj Nayarisseri, Principal Scientist, Eminent Biosciences, Vijaynagar, Indore, Madhya Pradesh, India.

Prof. Xiaoke Zhou, Assist. Prof., School of Computer Sciences and Technology, Soochow University, Suzhou, China.

Soft. Eng. Jorge Naranjo, HPC Applications Specialist, New York University (NYU), Abu Dhabi, UAE.

Thank you for your support!!!

MOL2NET Chairman

Scientific Committee (Local)

Coordinator Local Committee (Chemical Sciences)

Prof. Sonia Arrasate

Department of Organic Chemistry II,

University of Basque Country (UPV/EHU),

Leioa, Sarriena w/n, Bizkaia.

Email: [email protected]

Coordinator Scientific Committee (Neurosciences)

Prof. Shira Knafo

IKERBASQUE Professor

Molecular Cognition Laboratory

Biophysics Institute (CSIC, UPV/EHU)

Scientific and Technological Park of Biscay, University of The Basque Country UPV/EHU, Biscay, Spain. Ikerbasque, Basque Foundation for Science.

Coordinator Scientific Committee (Physical Sciences)

Prof. Juan M. Ruso

Department of Applied Physics, Faculty of Physics,

University of Santiago de Compostela (USC), Spain.

Email: [email protected]

Coordinator Scientific Committee (Computer Sciences)

Prof. Cristian R. Munteanu

Department of Computation, University of Coruña (UDC), A Coruña, Spain.

Email: [email protected]

[Honor Committee]

[Scientific Committee (Abroad)]

[Scientific Committee (Local)]

Scientific Committee Members

BioDonostia Health Research Institute

Prof. Marcos J. Araúzo-Bravo, Ikerbasque Professor, Bioengineering

CIC bioGUNE, Center for Cooperative Research in Biosciences

Prof. Nicola Abrescia, Ikerbasque Professor, Structural Virology Laboratory

University of Santiago de Compostela (USC)

Prof. Eugenio Uriarte Villares, Dept. of Organic Chemistry, USC, Spain.

Prof. Florencio Martínez Ubeira, Dept. of Microbiology and Parasitology, USC, Spain.

Prof. María Isabel Loza, Department of Pharmacology, USC, Spain.

Prof. Ramón J. Estévez Cabanas, Dept. of Organic Chemistry, USC, Spain.

Prof. Julio Seijas Vasquez, Dept. of Organic Chemistry, USC, Spain.

Prof. Carmen Cadarso-Suarez, Dept. Stat. and Operations Research, USC, Spain.

Assoc. Prof. Angeles Sánchez, Dept. of Inorganic Chemistry, USC, Santiago, Spain.

Assoc. Prof. Xerardo García Mera, Department of Organic Chemistry, USC, Spain.

Assoc. Prof. Eddy Sotelo, Dept. of Organic Chemistry, USC, Spain.

University of Vigo (UVIGO)

Prof. Yagamare Fall, Dept. of Organic Chemistry, University of Vigo (UVIGO), Vigo, Spain.

University of Cantabria (UC)

Prof. Jose Angel Irabien Gulias, Dept. of Chemical and Biomolecular Engineering ETSIIT, University of Cantabria, Spain.

University of Barcelona (UB)

Prof. Francesc Illas Riera, Institute of Theoretical and Computational Chemistry (IQTCUB), University of Barcelona, Spain.

Prof. Javier Luque Garriga, Department of Physical Chemistry, Universitat de Barcelona, Barcelona, Spain.

Consejo Nacional de Investigaciones Científicas (CSIC)

Prof. Pilar Goya, Institute of Medicinal Chemistry (IQM), CSIC, Juan de la Cierva st., Madrid, Spain.

Ph.D. Sonsoles Martin-Santamaría, Staff Scientist, CIB-CSIC, Mardid, Spain.

University of Valencia (UV)

Prof. Jorge Gálvez, Dept. of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain

Prof. Ramon García Domenech, Dept. of Physical Chemistry, Faculty of Pharmacy, Universitat de Valencia, Spain.

Universidad Politecnica de Madrid

Prof. Victor Maojo, M.D. Ph.D., Biomedical Informatics Group, Polytechnic University of Madrid, Spain.

Universida Complutense de Madrid

Prof. J. Carlos Mendez Ramos, Dept. of Organic Chem. and Pharm. Chem., Complutense University of Madrid, Spain

University of Girona

Prof. Emili Besalú Liora. Institut de Química Computacional i Catàlisi (IQCC), University of Girona, Spain.

University of Alicante

Assoc. Prof. José C. González-Gómez, Dept. of Organic Chemistry, University of Alicante, Alicante, Spain

Institute of Health Carlos III

PhD. Tirso Pons Hernández, Staff Scientist, CNIO, Institute of Health Carlos III, Madrid, Spain.

Scientific Committee Members (UPV/EHU)

UPV/EHU Headquarters Institutional Members

Prof. Carmen Iriondo Gabilondo, Head Dept. of Organic Chemistry II, UPV/EHU, Biscay, Spain.

Prof. Mª Isabel Moreno, Academic Secretary Dept. of Organic Chemistry II, UPV/EHU, Biscay, Spain.

UPV/EHU Committee Members

Prof. Claudio Palomo Nicolau, Director Department of Organic Chemistry I, UPV/EHU, Campus Gipuzkoa

Prof. Francisco Palacios Gambra, Department of Organic Chemistry I, UPV/EHU, Campus Vitoria

Prof. Jose Luis Vicario, Department of Organic Chemistry II, UPV/EHU, Campus Biscay

Prof. M.D. Javier Meana, Department of Pharmacology, Faculty of Medicine, UPV/EHU, Campus Biscay

Prof. Néstor Etxebarria Loizate, Dept. Analytical Chemistry, UPV/EHU, Campus Biscay

Prof. Luis Lezama, Department of Inorganic Chemistry, UPV/EHU, Campus Biscay

Prof. Mario Piris, Ikerbasque Prof., Donostia International Physics Center (DIPC), UPV/EHU, Campus Gipuzkoa

Assoc. Prof. Maria Luisa Carrillo Fernández, Dept. of Organic Chemistry II, UPV/EHU, Campus Biscay

Assist. Prof. Efraim Reyes Martín, Department of Organic Chemistry II, UPV/EHU, Campus Biscay

Assoc. Prof. Inmaculada Arostegui, Dept. of Applied Mathmatics and Statistics, UPV/EHU, Campus Biscay

Assoc. Prof. Aresatz Usobiaga, Department of Analytical Chemistry, UPV/EHU, Campus Biscay

Assoc. Prof. Maite Insausti, Department of Inorganic Chemistry, UPV/EHU, Campus Biscay

Assoc. Prof. Jose Luis Vilas, Department of Physical Chemistry, UPV/EHU, Campus Biscay

Assoc. Prof. Izaskun Gil de Muro, Dept. of Inorganic Chemistry, UPV/EHU, Campus Biscay

Ph.D. Jose Manuel Laza Terroba, Dept. of Physical Chemistry, UPV/EHU, Campus Biscay

Ph.D. Ailette Prieto Sobrino, Dept. of Analytical Chemistry, UPV/EHU, Campus Biscay

Ph.D. Jose Manuel Laza Terroba, Dept. of Physical Chemistry, UPV/EHU, Campus Biscay

Prof. M.D. Marta Arrasate Gil, Adjunct Prof., Faculty of Medicine, UPV/EHU, Campus Biscay

Assoc. Prof. Jose Luis Ayastuy Arizti, Dept. of Chemical Engineering, UPV/EHU, Campus Biscay

Adjunct Prof. Uxue Uria Pujana, Department of Organic Chemistry II, UPV/EHU, Campus Biscay

Adjunct Prof. Irantzu Barrio, Ph.D. Department of Applied Mathematics and Statistics, UPV/EHU, Campus Biscay

Thank you for your support!!!

MOL2NET Chairman

Co-Chairs Committee

[MOL2NET Homepage] [Honor Committee] [Scientific Committee (Abroad)] [Scientific Committee (Local)]

Co-Chairs (Experimental Sciences)

Dr. A.B. Reitz

Ph.D., CEO Fox Chase Chemical Diversity Center,

Inc., Doylestown, PA, USA.

Moore Fellow in the Management of Technology

University of Pennsylvania (Penn Engineering),

Adjunct Professor at Drexel University College of

Medicine, Founder CEO of ALS Biopharma, LLC.

Editor-in-Chief of Curr Top Medicinal Chemistry

Co-Chairs (Theoretical Sciences)

Prof. D. Bonchev

Director of Research on Bioinformatics,

Center for the Study of Biological Complexity.

Prof., Dept of Mathematics & Applied Mathematics,

Virginia Commonwealth University (VCU), USA.

Dr. S.C. Basak,

(1) Ph.D. Senior Scientist at Natural Resources Research Institute, Center for Water and the Environment (CWE), Duluth, MN, USA

(2) Adjunct Associate Professor, Department of Chemistry, University of Minnesota Twin Cities, MN, USA.

Headquarters & Institutional Co-Chairs

Prof. F.P. Cossío

Prof. Department of Organic Chemistry I,

University of Basque Country (UPV/EHU),

Donostia - San Sebastián Campus, Gipuzkoa.

(IKERBASQUE Foundation President)

Prof. E. Lete

Prof. Department of Organic Chemistry II,

University of Basque Country (UPV/EHU), Leioa,

Sarriena w/n, Bizkaia. [email protected]

(Coordinator Ph.D. Synth. & Ind. Chemistry)

Prof. N. Sotomayor

Department of Organic Chemistry II,

University of Basque Country (UPV/EHU), Leioa,

Sarriena w/n, Bizkaia. [email protected]

(Coordinator M.Sc. Synth. & Ind. Chemistry)

Prof. E. Domínguez Pérez

Department of Organic Chemistry II,

University of Basque Country (UPV/EHU),

Leioa, Sarriena w/n, Bizkaia.

(Dean of Faculty of Science and Technology)

Prof. Claudio Palomo Nicolau

Director Department of Organic Chemistry I,

University of Basque Country (UPV/EHU),

Donostia - San Sebastián Campus, Gipuzkoa.

(UFI-QOSYC Council Coordinator)

Thank you for your support!!!

MOL2NET Chairman

JCR Journals Special Issues

Special Issues

Nanomaterials

The members of committees and/or authors are encouraged to edit special issues for different journals of the editorial MDPI (http://www.mdpi.com/). For this edition we have opened one special issue entitled: Experimental Nanosciences, Computational Chemistry, and Data Analysis. This special issue have been opened on the journal Nanomaterials (ISSN 2079-4991), JCR IF = 2.609. The special issue is now in call for papers, submissions are welcome in a posteriori, in parallel, or totally independently from the conference. Manuscripts should be submitted online at www.mdpi.com by registering and logging in to this website. Once you are registered, click here to go to the submission form. The guest-editors board of this special issue includes (to be updated):

Guest Editor Prof. Dr. Humberto González-Díaz , Website1 \| Website2 \| E-Mail ¹ Department of Organic Chemistry II, University of the Basque Country UPV/EHU, 48940, Bizkaia, Leioa, Sarriena w/n, Spain ² IKERBASQUE, Basque Foundation for Science, 48011, Bilbao, Bizkaia, Spain
Guest Editor Prof. Dr. Bakhtiyor Rasulev , Website \| E-Mail North Dakota State University, Department of Coatings and Polymeric Materials, Fargo, USA
Guest Editor Dr. Shameer Khader , Website \| E-Mail Director of Bioinformatics, Data Science and Precision Medicine, Healthcare Integration Services, Philips, Cambridge, MA, USA

International Journal of Molecular Sciences

See also, as example, the previous Special Issue on Data Analysis in Molecular Sciences. This issue was published in 2016 on the International Journal of Molecular Sciences (IJMS), IF = 3.257. The issue included 18 papers in total (some of them from the conference). In order to send a proposal of associated workshop and/or special issue contact the chairperson of the conference and UPV/EHU Ikerbasque Professor Prof. H. González-Díaz .

Workshops/Sections Schedule

MOL2NET Workshops/Sections Schedule

General Schedule

MOL2NET International Conference Series on Multidisciplinary Sciences, MDPI Sciforum, Basel, Switzerland has online sections (3) and workshops (>10) associated. The conference runs officially from Oct-05 to Dec-20 (of the year in course) at the online platform SciForum maintained by the editorial MDPI, Basel, Switzerland. However, the platform is open from Feb-15 to Dec-20 of the year in course for practical reasons; e.g., accommodation of many workshops in different dates along the year, reception of communications, etc.

Schedule for Submission and Publication of communications

As we mentioned before, despite the official dates the online sections (1-3) open at the beginning of the year in course (Feb-15) and are open all the year for submissions of communications in order to enable the accommodation of all workshops in different dates along the year. The associated workshops open in different dates along the year (see specific workshop pages). Submission of papers to all sections/workshops is open until Dec-15 of the year in course (2017 for present edition). The publication of communications is continuous all the year upon acceptance.

Schedule for Online participation

After publication of papers is closed we open the online platform from Dec-15 to Dec-20 of the year in course (2017 for present edition) for online participation. The authors will be able to post online comments and/or answers to comments in this workshop/section and also in the other general sections and/or >10 international workshops of the MOL2NET conference (many of them also run both online and in person). The participants are entitled to receive participation certificates for MOL2NET conference and all the workshops they participate upon request to the respective chairpersons. See committees of MOL2NET and each workshop.

Schedule for in person participation

Many of the workshops associated to MOL2NET are going to be held also in person (face-to-face) in different universities of USA, Spain, Italy, Mexico, Chile, etc. This in person workshops have specific schedules in parallel to their online versions. Please, go to the homepages of these workshops and/or contact their chairpersons for further details.

Notes on Topics

MOL2NET International Conference Series on Multidisciplinary Sciences focus on multiple topics of interest for modern sciences due to his multidisciplinary scope. The topics of interest include, but are not limited to, Chemistry (All areas), Mathematics (Applied), Physics (Applied), Materials Science, Nanotechnology, Biology and Life Sciences (All areas), Medicine, Biomedical Engineering, Education, along with Computer Sciences, Data Analysis, Statistics, Artificial Intelligence, Deep Learning, Bioinformatics, Systems Biology, and Complex Networks Sciences.

However, papers focused on the following topics are in general outside of the scope of the conference and the associated workshops. See the following list of topics outside the scope of the conference and associated workshops:

- Astronomy, Cosmology, etc. (due to lack of expertise of the committee)

- Quantum physics of elemental particles (due to lack of expertise of the committee)

- Physical and biological properties emerging after vigorous shaking of highly diluted systems.

About This Conference

About MOL2NET 2017, International Conference on Multidisciplinary Sciences, 3rd edition

This conference is organized by Prof. Humbert González-Díaz. Sciforum is not responsible for the content posted on this website.

MOL2NET is an International Conference Series to Foster Interdisciplinary Collaborations in Sciences with emphasis on Experimental Chemistry (all branches), Materials Science, Nanotechnology, Life Sciences, Medicine, and Healthcare, along with Data Analysis, Computer Sciences, Bioinformatics, Systems Biology, and Complex Networks Sciences.

Thank you for your support!!!

MOL2NET Chairman

IKERBASQUE Committee

MOL2NET-IKERBASQUE Committee

Note: In this section we list Professors related to IKERBASQUE, Basque Foundation for Science who are members / supporters of some MOL2NET conference committee.

Honor Committee

Prof. Fernando P. Cossío, Ikerbasque President, Department of Organic Chemistry I, UPV/EHU, Gipuzkoa Campus

Prof. Jesús Jimenez Barbero, Ikerbasque Professor, Scientific Director of Center CICBiogune, Biscay

Prof. Luis M Liz-Marzán, Ikerbasque Professor, Scientific Director of Center CICbiomaGUNE, Gipuzkoa

Scientific Committee

Prof. Shira Knafo, Ikerbasque Professor, CSIC-UPV/EHU Biophysics Institute

Prof. Marcos J. Araúzo-Bravo, Ikerbasque Professor, Bioengineering, BioDonostia Health Research Institute

Prof. Nicola Abrescia, Ikerbasque Professor, CIC bioGUNE, Center for Cooperative Research in Biosciences

Prof. Mario Piris, Ikerbasque Prof., Donostia International Physics Center (DIPC), UPV/EHU, Campus Gipuzkoa

MOL2NET Chairman

00. Editorial & Proceedings Book

[Homepage] [Honor Committee] [Steering Committee] [Scientific Committee (Abroad)] [Scientific Committee (Local)]

Welcome Message

We are glad to invite all colleagues worldwide to participate on a new edition of this International Conference Series. The official title of this conference series is MOL2NET International Conference Series on Multidisciplinary Sciences. MOL2NET (the conference running title) is the acronym of the lemma of the conference: From Molecules to Networks. This running title is inspired by the possibility of multidisciplinary collaborations in science. The topics of interest include, but are not limited to, Chemistry (All areas), Mathematics (Applied), Physics (Applied), Materials Science, Nanotechnology, Biology and Life Sciences (All areas), Medicine, Biomedical Engineering, Education, along with Computer Sciences, Data Analysis, Statistics, Artificial Intelligence, Deep Learning, Bioinformatics, Systems Biology, and Complex Networks Sciences. See the following note to authors on topics outside the scope of the conference and associated workshops [Note on topics].

THANK YOU FOR YOUR SUPPORT!!!

Sincerely yours

MOL2NET Chairman

MOL2NET Sponsors

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Submissions

List of Papers (1) Toggle list

01. Chemistry (All Areas), Soft Matter Physics, Pharmaceutical Sciences, Polymer, and Nanosciences

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This section covers: All areas of Chemistry, including, Inorganic, Analytical, Physical, Organic, Medicinal, and Theoretical Chemistry as well as Soft Matter Physics, Biophysics, Polymers, Materials, Pharmaceutical Sciences, and Nanosciences.

The topics of interest include both experimental and theoretical research in these areas. Including, but not limited to, Organic synthesis, Chemical reactivity, Catalysis, Solid State Chemistry, Inorganic Crystals, Crystal Symmetry, and Complexes. Physicochemistry and Analytical chemistry techniques; Spectroscopy (X-Ray, NMR, IR, EPR, Mass Spectroscopy), Chromatography and sample preparation techniques, TEM and SEM Microscopy.

The section also covers experimental and/or theoretical analysis of artificial polymers, biopolymers, materials, nanomaterials, etc. Experimental and theoretical study of carbon nanomaterials (Graphene, Fullerenes, Nanotubes, Diamonoids), Ceramic materials, Alloys. Biopolymeric Nanomaterials for biosciences (drug carriers, diagnosis tools, medical imaging) including Dendrimer, Protein nanoparticle. Shape Memory Polymers, Nanopatterning, and Surface Imprinting.

Last but not least, the section includes studies in theoretical and computational methods: Chemoinformatics and Computer Aidded Drug Design (CADD) methods, Computational Chemistry, Quantum Mechanics (Ab inition, DFT, MP3, AM1 methods), Monte Carlo (MC) algorithm, Quantitative Structure-Reactivity, Structure-Property, or Structure-Retention Relationships (QSPR/QSRR) models in organic, inorganic, physical and analytical chemistry. Experimental Design, Chemometrics, Formulation Design, and Data Analysis in Analytical chemistry and Pharmaceutical sciences.

See as example, the communications of the same section in previous editions:

MOL2NET 2016, Section 01 (Chemistry All Areas, Nanosciences, Polymers)

MOL2NET 2015, Section 01: Section A (Chemistry) , Section C (Soft Matter Physics, Polymers, Materials)

Thank you for your support!!!

MOL2NET Chairman

Session Chairs

Professor Esther Lete

Dr. Nuria Sotomayor

Professor Sonia Arrasate Gil

Show all published submissions (31) and accepted abstracts (2)

Submissions

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List of Accepted Abstracts (2) Toggle list

02. OMICs, Biotechnology, Bioinformatics, Neurosciences, and Biomedical Engineering

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This section covers experimental and computational methods in Life Sciences in general: OMICS, Molecular Biology, Biotechnology, Bioinformatics, Biomedical Engineering, and related topics. Experimental and theoretical methods applied to drug discovery, biomarkers and target validation, vaccine design, in biosciences. In experimental studies: Pharmacological assays, Toxicity and Cytotoxicity studies, Molecular Biology and Biotechnology. Proteomics, Genomics, and Metabolomics (OMICS methods) like Sequencing, Cloning, DNA microarrays, and Mass Spectroscopy in Clinical Proteomics.

The section also include the use of computational techniques in the previous fields. Some examples are: Molecular Mechanics and Molecular Dynamics (MM/MD) for Drug-protein Docking studies, Quantitative Structure-Activity / Toxicity Relationships (QSAR / QSTR) models. Bioinformatics analysis of Disease Biomarkers and Computational vaccine design (Alignment and Alignment-free techniques). Determination of the 3D proteins structure using NMR and X-ray techniques. Experimental and computational study of RNA (Rnomics), secondary RNA structure prediction, miRNA biomarkers. As well as, Computational Systems Biology, Complex Networks Analysis for OMICS, Networks Analysis in Ecology, Mathematical Biology, etc.

The section includes in addition: Biomedical Engineering, and Medical Informatics. Biomedical research, experimental and/or computational medical diagnostic tools in cancer research, neurosciences, clinic and biomedical engineering. Including, but not limited to, EEG and structural NMR in clinical diagnosis in neurology and brain research. EEG, fNMRI, microscopy, tomography, study for tissue connectivity analysis, including the use of experimental techniques and complex networks computational analysis in neurosciences, bone tissue connectivity, vascular system connectivity, etc.

See, as example, the presentations of the same section on last editions:

MOL2NET 2016, Section 02 (OMICS, Biotech, Bioinfo, Biomed Eng)

MOL2NET 2015, Section B (Med Chem, Omics, Biosciences)

Thank you for your support!!!

MOL2NET Chairman

Show all published submissions (14) and accepted abstracts (2)

Submissions

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03. Computational Sciences, Statistics, Artificial Intelligence, Complex Networks, Machine Learning, and Big Data

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This section covers the different applications of computer sciences, data analysis, statistics, modelling techniques, etc. in multidisciplinary sciences. The topics include, but are not limited to, connectivity analysis in biology, environment, epidemiological, and social networks; including the computational analysis of metabolic pathways in Metabolomics, Protein interaction networks in proteomics, food webs, and other biological-ecological networks like host-parasite, prey-hunter, etc. Geographical Information Systems (GIS), land covering networks, atmospheric reactions networks. Study of social collaboration, electronic social networks (Facebook, Twitter, etc.), disease spreading networks and epidemiology, vaccination models in epidemic networks, legal and law citing networks, networks in sociology and criminology, etc.

This section covers also: technological, industrial, and economic connectivity, including the analysis of computer connectivity, Internet, wireless networks, satellite networks, electrical networks, airport and other transport networks, financial networks, trade networks, etc. In addition, we cover pure theoretical aspects in network science and data analysis theory, including but not limited to theoretical studies in network sciences, topological indices, node centrality, network robustness, multiplex networks, network attack, and new spatial statistical analysis, time series analysis, biostatistics, machine learning and big data analysis methods.

This section is also aimed at presenting the most commonly used software tools in Multidisciplinary Science. Include, but is not limited to, new scientific software, web servers, databases, etc. with applications in Chemistry (all branches), Bioinformatics, Proteomics, Biotechnology, Medical Informatics and Biomedical Engineering, Computer Science, etc.

The short communications should present computational tools that may be desktop/web/mobile applications/scripts, open code or private software. The tool may be original or a pipe of other tools. It should contain a software description, case uses in order to understand how to employ it, links to the open repositories (GitHub, GitLab, Personal Webs, etc.) or official Webs of the private products, and references of the publications where the tools have been applied. The authors may include in the communication a link to their personal webs, web servers, repositories, databases, etc.

Special attention will be paid to the links to tutorials (blogs, videos, etc.), print screens with the tools in action, pseudocodes, examples of input and outputs, script examples while using the tools, and links to the social network posts for the tools. The emphasis of this section is on the software per se. Communications that make use of a software to solve a practical problem but do not put emphasis on describing it could be suitable for other sections.

We also welcome submissions related to: Client–server model — Client–server computing, Grid computing with a cluster of networked, loosely coupled computers to perform very large tasks, Distributed Fog computing paradigm, Dew computing, Mainframe computer for big data processing in large research organizations, Utility computing, and Peer-to-peer computing alternatives in science and medical informatics.

Enjoy programming for science!

See examples in similar sections of the last editions:

MOL2NET 2016, Section 03 (Computational Sciences)

MOL2NET 2015, Section E (Statistics, Artificial Intelligence)

Thank you for your support!!!

MOL2NET Chairman

Show all published submissions (10) and accepted abstracts (1)

Submissions

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04. SRI-09: 9th Summer Research Institute Symposium, STU-MDC, Miami, USA, 2017

NOTES: Before to submit your communication we strongly recommend to read to read carefully the notes to participants at the end of the welcome message and/or the notes in the following page [Notes to authors] about publication model, copyright, authors responsibilities, etc.

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Welcome Message

Nine years have gone since the First STU-MDC Summer Research Institute (SRI) Symposium. Over the years, faculty members from both institutions, School of Science, Technology, and Engineering Management of Saint Thomas University (STU) and Miami Dade College (MDC), have partnered to provide undergraduate students hands-on experiences and computational projects that will prepare them for the new challenges of the modern world and the job market. The commitment of the faculty and staff of the School of Science, Technology and Engineering Management has permitted to introduce students into modern techniques of molecular biology, statistical analysis, mathematical modeling, computational physics, bioinformatics, nano sciences and a large variety of characterization techniques. During this last edition, students exchanged experiences with researchers from University of Miami, Florida International University (FIU) and also from NASA,

For the second time, this year, the memories of the SRI will be hosted online by the MOL2NET conference series. It means, that all communications will be published online at Sciforum platform. All presentations will be peer reviewed and a DOI number will be assigned. MOL2NET conference of Sciforum is one of the platforms with international recognition for scientific exchange. The variety of topics included within this new edition acknowledges the inter-disciplinarity, teamwork, and networking of modern science. Feel free to contact researchers and participants to foster more collaboration efforts. St. Thomas University School of STEM is open to new ventures and joint ventures. Interested to see previous edition can follow the link SRI-08 and witness the quality of 38 submissions with a total of 21 publications. The new edition SRI-09 received a total of 27 submissions.

Special thanks to our partner Miami Dade College (MDC) and the grant STEM-SPACE P03C1160161. The received contributions provided funding for equipment, logistics, and minor activities associated with the SRI. Ten speakers from and local Technological companies came to St. Thomas to share their wisdom as an in kind contribution.

Thank you for your support!

SRI Chairman

Prof. Dr. David Quesada, Associate Professor of Physics, (MOL2NET Committee)
Saint Thomas University (STU), Carnival Building, Room 117, Miami, FL, USA.
Email: [email protected]

Scientific Committee

Prof. Dr. Alexis Tapanes-Castillo, Assistant Professor of Biology
School of Science, Technology and Engineering Management,
St. Thomas University (STU), Miami, FL, USA.
Email: [email protected]

Prof. Dr. Reinaldo Sanchez-Arias, Assistant professor of Mathematics,
School of Science, Technology and Engineering Management,
St. Thomas University (STU), Miami, FL, USA.
Email: [email protected]

Prof. Dr. Luis Fernandez-Torres, Assistant Professor of Chemistry,
School of Science, Technology and Engineering Management,
St. Thomas University (STU), Miami, FL, USA.
Email: [email protected]

Advisory Committee

Prof. Cristian R. Munteanu,
INIBIC Institute of Biomedical Research, CHUAC, UDC, 15006 Coruña, Spain.
RNASA-IMEDIR, Computer Sciences Faculty, University of Coruña, 15071 Coruña, Spain.

Dr. Aliuska Duardo-Sanchez (Law.Lic., Ph.D. Legal Informatics)
Prof. of Law, Program Juan de La Cierva (JdC) Post-Doctoral Research Fellow,
Department of Public Law, University of Basque Country (UPV/EHU),
Campus Biscay, Leioa, 48940, Spain.

Advisory Chair

Prof. Dr. González-Díaz H., IKERBASQUE Professor

(1) Department of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Spain.
(2) IKERBASQUE, Basque Foundation for Science , 48011, Bilbao, Biscay, Spain.
ORCID: https://orcid.org/0000-0002-9392-2797

[SRI09 PHOTO GALLERY]

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Submissions

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05. WCUCW-01 West Coast University Capstone Workshop, WCU, Miami, USA, 2017

WCUCW-01

NOTES: We suggest you to download and use the [Template File] to write your communication. We also strongly recommend you to read carefully the [Instructions to authors] about publication model, copyright, authors responsibilities, etc.

[REGISTER/LOG IN TO SUBMIT]

Dear colleagues worldwide, we invite you to join us at WCUCW-01 West Coast University Capstone Workshop, 2017, Miami, FL, USA. This is the Capstone workshop for West Coast University (WCU), Miami, FL, USA. This workshop series held each academic term is devoted to fostering both education and research in multidisciplinary sciences. Nursing students completing their General Education courses at WCU form groups of three and take on the roles of scientist, medical researcher, or public health professional, all of them approaching an assigned topic from their field of expertise. They are each required to devise a study on their topic, pretend to conduct it, generate logical data to support a hypothesis, write an academic paper sharing their findings, and defend their data in a presentation.The workshop education goals focus on professors and students in the WCU Miami campus Capstone course. However, we also welcome researchers and students from other nationwide WCU campuses and researchers from other institutions around the world.

The Capstone workshop is associated with MOL2NET-03 International Conference on Multidisciplinary Sciences, MDPI Sciforum, Switzerland, HQ UPV/EHU, Bilbao, Spain. It will therefore run both online and in person. The workshop runs online at the platform SciForum maintained by the editorial MDPI, Basel, Switzerland.It runs in person at WCU, Miami campus, during the Capstone course. The topics of interest include, but are not limited to, the following: Multidisciplinary Science (all areas), Health Science (all areas), Chemistry (all areas), Biology and Life Sciences (all areas), Environmental Science (all areas), Social Sciences (all areas), Biomedical Engineering, Mathematics (Applied), Data Analysis, Education. See the following note to authors on topics outside the scope of the conference and associated workshops [Note on topics].

Steps for Participation

(0) Register, Sign in/Login, to Sciforum platform [Sciforum login] (all year)

(1) Submit the title and abstract, select a section or workshop (do not upload paper here) [Submit New Abstract]

(2) Wait for Sciforum abstract acceptance email, follow the link, and/or login to upload paper(doc and pdf format)

(3) Download template doc and prepare your communication [Template File]

(4) Wait for paper acceptance and publication emails (follow link to proofread your paper, ASAP after upload)

(5) Communicate with chairpersons if corrections are necessary, including past editions (all year)

(6) Log in to post comments, questions, or answers in a section or one of the workshops

(7) Contact chairpersons if you need author (publication) or attendance (posting) certificate for conference and/or workshops (all year)

Notes to Participants

To see a detailed schedule of this workshop/section and of the entire conference follow this link:[MOL2NET workshops schedule]

Preliminary communications are not post-print journal papers. In this sense, committee and/or external reviewers check only scope and apparent scientific soundness. They have the same editorial process as for an online Preprint service. Therefore, all works receive DOI numbers and indexed in GoogleScholar. The works may also receive comments from registered participants (public post-publication review). The authors are encouraged to submit their works to peer-reviewed scientific journals of MDPI or other editorials during or after finalization of the conference, as per SciForum copyright rules.

Comments on previous works are short notes to comment about the more interesting points, highlights, etc. of works previously published by the authors or other groups. In this case, committee and/or external reviewers also only check the scope and apparent scientific soundness. The works may also receive comments from registered participants (public post-publication review).

After publication of papers is closed, we shall open the online platform, and the authors (professors, researchers, and students) will be able to post online comments, questions, and/or answers to comments in this workshop/section and also in the other general sections and/or >10 international workshops of the MOL2NET conference. (Many of them also run both online and in person.)

We strongly recommend that you carefully read the following notes to participants about publication model, copyright, authors’ responsibilities, etc. Be aware, it is the author’s responsibility to ensure the veracity of the contents(checking similarity to other works) and to carry out a proper citation of previous works. The committee is not responsible of these aspects in this publishing modality. We therefore strongly recommend the authors to use online text-similarity checking services to avoid any form of plagiarism or copyright violation. The authors may be requested to modify the communication (re-write their texts) in the case that high similarity is detected and reported to the committee. In these cases, the manuscript could be put on standby or withdrawn temporarily until the authors re-submit the proper version. The authors are also allowed to submit short reviews, comments, letters, or discussions of papers already published if they guarantee sufficient difference to previous public contents.

Steering Committee (Chairpersons)

Chairpersons

Prof. Melissa Cueto, Email: [email protected]
MAInstructor II, West Coast University, Miami, FL, USA
Adjunct Prof., University of Miami, Coral Gables, FL, USA.

Prof. Maykel Cruz-Monteagudo, Email: [email protected]
Education Specialist, West Coast University, Miami Campus, FL, USA.

Institutional Chairperson

Prof. Terace Fletcher, PhD, MS, Email: [email protected]
Academic Dean and Professor, West Coast University, Miami Campus, FL, USA.

Advisory Scientific Committee

Committee Members

Prof. Lazaro Pino, Assoc. Prof., West Coast University (WCU), Miami, FL, USA.
Professor of Chemistry, San Ignacio University (SIU), Campus Miami, FL, USA.
Adjunct Professor, Miami Dade College (MDC), Miami, FL, USA.

Dr. Aliuska Duardo-Sanchez (Law.Lic., Ph.D. Legal Informatics)
Prof. of Law, Program Juan de La Cierva (JdC) Post-Doctoral Research Fellow,
Department of Public Law, University of Basque Country (UPV/EHU),
Campus Biscay, Leioa, 48940, Spain.

Advisory Chairman

Session Chairs

Dr. Melissa Cueto

Dr. Maykel Cruz-Monteagudo

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06. USINEWS-01; US-IN-EU Worldwide Science Workshop Series, UMN, Duluth, USA, 2017.

USINEWS-01; US-IN-EU Worldwide Science Workshop Series, UMN, Duluth, USA, 2017.

USINEWS-02

[MOL2NET 2015] [MOL2NET 2016] [MOL2NET 2017] [FACEBOOK (>10K followers)]
[Welcome Videos] [官话 ] [हिन्दी] [Euskera] [Castellano] [Português] [Français]

[CLICK HERE TO SUBMIT NEW ABSTRACT]

(YEAR-ROUND PUBLICATION, OPEN ACCESS, AND FREE OF CHARGE)

USINEWS-01; US-EU India Worldwide Science Workshop Series, UMN, Duluth, USA, is aimed to become a reference international science workshop series. USINEWS series focused on the interchanges of ideas among India researchers working in India or abroad (U.S., Europe, etc.) with colleagues from other countries across the world. In fact, this workshop (formerly known as INDOWSCI) have headquarters in USA, Europe, and India. Consequently, you should consider both university of University of Minnesota, MN, USA and Netaji Subhas Institute of Technology, New Delhi, India (see chairpersons below) as the two main host institutions. In Europe, professors endowed by IKERBASQUE, Basque Foundation for Sciences and the University of Basque Country (UPV/EHU), are the main supporters and in charge of online publication headquarters.

The foundations of this workshop are in the multiple collaborations of Professors / Researchers of Indian researchers like Dr. Suhbash C. Basak, University of Minnesota, USA, Prof. Kunal Roy, Jadavpur University, Dr. Shameer Khader, Philips Healthcare, Cambridge, MA, USA, with their international colleages at Virginia Commonwealth University (VCU), University of Coruña (UDC), University of Basque Country (UPV/EHU), IKERBASQUE, Basque Foundation for Sciences, and many other institutions in US-EU, India, and other countries.

The workshop is inspired on the Indo-U.S. Workshops series organized by Dr. Suhbash C. Basak during many years, as example of multicultural melting pot devoted to promote interdisciplinary collaborations in science. The works on this initiative started in 1990; the first event was organized in 1998 at Visva Bharati University, West Bengal, India. The Lecture Series was mainly to train young scholars. The third line of events was geared to benefit the South American scientists and young scholars. Two events have been held in Colombia. Some reports of these workshops are: [J. Chem. Inf. Comput. Sci., 1999, 39 (2), pp 179–179], [J. Chem. Inf. Comput. Sci., 2001, 41 (3), pp 479–479], [J. Chem. Inf. Model., 2006, 46 (1), pp 1-1], These workshops included:

(1) Indo-US Workshop on Mathematical Chemistry Series, beginning in 1998 in India and having six more events both in USA and India

(2) Indo-US Lecture Series on Discrete Mathematical Chemistry, four events mainly focusing on the training of young scholars.

(3) Mathematical Chemistry Workshops of the Americas (involving countries of North and South Americas)

USEINWSCI workshop series is associated to MOL2NET-03 International Conference on Multidisciplinary Sciences, MDPI Sciforum, Switzerland, HQ UPV/EHU, Bilbao, Spain. Consequently, it aims to promote results on Multidisciplinary Science (All Areas), including but not limited to, the following topics of interest: Chemistry (All areas), Mathematics (Applied), Physics (Applied), Materials Science, Nanotechnology, Biology and Life Sciences (All areas), Medicine, Biomedical Engineering, Education, along with Computer Sciences, Data Analysis, Statistics, Artificial Intelligence, Deep Learning, Bioinformatics, Systems Biology, and Complex Networks Sciences. See the following note to authors on topics outside the scope of the conference and associated workshops [Note on topics].

Steps for Participation

(0) Register, Sign in/Login, to Sciforum platform [Sciforum login]

(1) Submit the title/abstract to workshop [Submit New Abstract] (do not upload paper here), until 2018-Jan-20

(2) Download template doc and prepare your communication [Template File], until 2018-Jan-20

(3) Wait for Sciforum abstract acceptance email, until 2018-Jan-20

(5) Follow the link in the email or login to upload paper (doc and pdf format) until 2018-Jan-20

(4) Wait for paper acceptance and publication emails (follow link to proofread your paper)

(5) Communicate with chairpersons if corrections are necessary

(6) Login to post comments, questions, or answers in a section or in one of the MOL2NET workshops (2017-Dec-15 to Dec-20)

(7) Contact chairpersons if you need author (publication) or attendance certificate (posting) of MOL2NET sections or workshops

Notes to Participants

Before to submit your communication recommend to download and use the [Template File] to write your communication; we strongly recommend you to read carefully the following notes to participants about publication model, copyright, authors responsibilities, etc Firstly, be aware that the works published here belongs to two main modalities preliminary communications or comments on previous works.

Preliminary communications are not post-print journal papers. In this sense, committee and/or external reviewers check only scope and apparent scientific soundness. They have the same editorial process than for an online Preprint service. Therefore, all works receive doi number and are indexed in databases (GoogleScholar, Publons, etc.).The works may receive also comments from registered participants (public post-publication review). The authors are encouraged to submit their works to a peer-reviewed scientific journals of MDPI or other editorials during or after finalization of the conference, as per SciForum copyright rules.

Comments on previous works are short notes to comment about the more interesting points, highlights, etc. of works previously published by the authors or other groups. In this case, committee and/or external reviewers check also only scope and apparent scientific soundness. The works may receive also comments from registered participants (public post-publication review).

In any case, it is the authors responsibility, to ensure the veracity of the contents, checking similarity to other works, and carry out a proper citation of previous works. The committee is not responsible of this previous aspects in this publishing modality. In this sense, we strongly recommend the authors to use online text-similarity checking services to avoid any form of plagiarism or copyright violation. The authors may be requested to modify the communication (re-write their texts) in the case that high similarity is detected and reported to the committee. In these cases, the manuscript could be put on standby or withdrawn temporarily until the authors re-submit the proper version. The authors are also allowed to submit short reviews, comments, letters, or discussions of papers already published if they guarantee sufficient difference to previous public contents.

Scientific Committee

INDOWSCI Honor Chairpersons

Dr. Suhbash C. Basak, Natural Resources Research Institute, Duluth, MN, USA. (North America)

Prof. Ashok. K. Dubey, Head of Division, Dean International Affairs, NSIT Netaji Subhas Institute of Technology, New Delhi, India (Asia)

Prof. Kunal Roy, Dept. of Pharmaceutical Technology, Jadavpur University, Kolkata, India. (Asia)

Dr. Shameer Khader, Dept. of Medical Informatics and Research Informatics, Northwell Health, NY, USA (North America)

Organizing Committee

M.Sc. Rajeev K Singla (M.Pharm), NSIT Netaji Subhas Institute of Technology, New Delhi, India.

Scientific Committee

Prof. Kirtan Dave, Center for Interdisciplinary Studies in Science and Technology, Sardar Patel University, India

Prof. Cristian R. Munteanu, Department of Computation, University of Coruña (UDC), A Coruña, Spain.

Dr. Advait Apte, Scientific Programmer, Department of Biology, City College of New York, New York, NY, USA.

Dr. Anuraj Nayarisseri, Principal Scientist, Eminent Biosciences, Vijaynagar, Indore, Madhya Pradesh, India.

Dr. Girinath G. Pillai, Zastra Innovations, Bengaluru, Karnataka, India.

Advisory Chairman

Session Chairs

Mr. Rajeev K Singla, Division of Biological Sciences and Engineering, Netaji Subhas Institute of Technology

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07. IWIMSM-01: Iberoamerican Workshop on Modelization and Simulation, UCV, Valencia, Spain, 2017

IWIMSM-01: Iberoamerican Workshop on Modelization and Simulation Methods, Valencia, Spain, 2017

[Submit New Abstract]

Welcome Message

We are glad to invite all colleagues worldwide to participate on the workshop IWIMSM-01: Iberoamerican Workshop on Modelization and Simulation Methods, Valencia, Spain, 2017. This is a joint workshop promoted by professors of the Institute of Molecular Science (ICMol) and the Faculty of Pharmacy of the University of Valencia (UV), and the Catholic University of Valencia (UCV), Valencia, Spain. MOL2NET (the conference running title) is the acronym of the lemma of the conference: From Molecules to Networks. IWIMSM-01: Iberoamerican Workshop on Interdisciplinary Modelization and Simulation Methods, Valencia, Spain, 2017. This workshop is associated to the MOL2NET International Conference Series on Multidisciplinary Sciences.

Scope and Target Audience

This conference is in large measure targeted at under-graduated, MSc, and PhD students, as well as Professors, Engineers, and Researchers focused on the application of Computational Modelling and Simulation techniques. The fields of application include, but are not limited to, Medicinal Chemistry, Computational Chemistry, Materials and Nanosciences, Bioinformatics, Biotechnology, Systems Biology, Biomedical Engineering, Environmental Sciences, Social Sciences, Scientometrics, etc. The algorithms used may also come from different areas including, but not limited to, Discrete Mathematics, Mathematical Analysis, Complex Networks Sciences, Statistics, Data Analysis, Artificial Intelligence, Machine Learning, Deep Learning, etc.

Abstract preparation and submission

Before to submit your communication we recommend to download and use the [Template File] to write your communication. We also strongly recommend you to read carefully the notes to participants at the following page [Instructions to authors] about publication model, copyright, authors responsibilities, etc. Submit your communications in two steps, first submit your title, authors, and abstract here: [Submit New Abstract]. Next, upload your communication after abstract approval.

Steps for Participation

(0) Register, Sign in/Login, to Sciforum platform [Sciforum login] (All the year)

(1) Submit the title and abstract, select a section or workshop (do not upload paper here) [Submit New Abstract] (until Dec-15)

(2) Wait for Sciforum abstract acceptance email, follow the link, and/or login to upload paper, doc and pdf format (until Dec-15)

(3) Download template doc and prepare your communication [Template File] (until Dec-15)

(4) Wait for paper acceptance and publication emails (follow link to proofread your paper) (Asap after upload)

(5) Communicate with chairpersons if corrections are necessary, including past editions (All the year)

(6) Log in to post comments, questions, or answers in a section or one of the workshops (Dec-15 to Dec-20)

(7) Contact chairpersons if you need author (publication) or attendance (posting) certificate for conference and/or workshops (All the year)

Steering Committee (Chairpersons)

Prof. Gloria Castellano, Email: [email protected]Director of Department of Experimental Sciences and Mathematics, Catholic University of Valencia (UCV), Valencia, Spain.
Editor of NEREIS, ISSN: 1888-8550, Revista Iberoamericana Interdisciplinar de Métodos, Modelización y Simulación

Prof. Francisco Torrens, Email: [email protected]Institute of Molecular Science (ICMol), University of Valencia (UV), Valencia, Spain.

Scientific Committee (Local)

Prof. Jorge Gálvez, Full Prof., Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain

Prof. Ramon García-Domenech, Full Prof., Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain.

Prof. Facundo Pérez Giménez, Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain.

Prof. Jesus V. De Julián Ortiz, Tenure-track 1, Department of Physical Chemistry, Faculty of Chemistry, University of Valencia, Spain.

Dr. Maria Galvez-Llompart, Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain.

Dr. Riccardo Zanni, Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia, Spain.

Scientific Committee (Abroad)

Prof. Alejandro Pazos, Ph.D., M.D., Director of Department of Computation, University of Coruña (UDC), Coruña, Spain.

Prof. Cristian R. Munteanu, Department of Computation, University of Coruña (UDC), A Coruña, Spain.

Prof. Juan M. Ruso, Department of Applied Physics, University of Santiago de Compostela (USC), Spain.

Prof. Natalia D.S. Cordeiro, Department of Chemistry and Biochemistry, University of Porto, Porto, Portugal.

Prof. Carolina Horta Andrade, Universidade Federal de Goias, Setor Leste Universitario, Goiania, Brazil.

Prof. Yovani Marrero-Ponce, University San Francisco de Quito, Cumbayá, Quito, Ecuador.

Advisory Chairman

Session Chairs

Dr. Gloria Castellano

Professor Francisco Torrens

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08. LAWSCI-01: Challenges in Law, Technology, Life, and Social Sciences, UPV/EHU, Bilbao, Spain, 2017

MOL2NET2017, LAWSCI01

[SUBMIT HERE] (Select MOL2NET Conference, Section LAWSci)

Dear colleagues worldwide,

We are glad to invite you to participate in the workshop LAWSci, Challenges in Law, Technology, Life, and Social Sciences. This workshop will be held from 25-30 Oct, 2017, online at Sciforum platform. This is a workshop associated to the MOL2NET International Conference Series on Multidisciplinary Sciences, MDPI Sciforum, Switzerland, HQ UPV/EHU, Bilbao, Biscay, Spain.

LAWSci workshop series promotes multidisciplinary collaborations and debate in the frontiers of Law, Technology, Life, and Social Sciences. The interaction between bio-science and ICTs has forged great developments in many fields. However, the appreciation of these discoveries is sadly, all too often, accompanied by a lack of understanding of the legal implications. This conference series aims to provide a reference to the various legal avenues that are available for the protection of scientific advances, but also the legal instruments to protect society from unwanted effects. It constitutes a study of some of the legal implications of bioscience and ICT advances, weighing their impact on society and the law's role in shaping that effect.

In this sense, the presentations will be focused on legal trends in different fields covering, but not limited to: patentability in plants and human genomics, clinical procedures’ standards, patients’ personal data protection, informed consent, regulatory issues in drug discovery, biomedical research legislation, toxicology, medico-legal problems such as healthcare malpractice, medical insurance or ethics in medical practice, software protection in chemo-informatics, bioinformatics, medical informatics, and social sciences, taxes in the biotechnology industry and causality/liability in environmental pollution, criminology, etc. The conference will run on-line and free, saving traveling and participation costs (subscriptions, open publication, participation in forum, certificates, etc., are free of cost).

Publication Model and Authors Responsibility:

Before to submit your work be aware that the editorial process is the same than for a PREPRINT service. Therefore, all works receive doi number and are indexed in databases (GoogleScholar, Publons, etc.). However, the works published here are preliminary communications and not post-print journal papers. In this sense, committee and/or external reviewers check only scope and apparent scientific soundness. The works may receive also comments from registered participants (public post-publication review). The authors are encouraged to submit their works to a peer-reviewed scientific journals of MDPI or other editorials during or after finalization of the conference, as per SciForum copyright rules.

In any case, it is the responsibility of the authors, to ensure the veracity of the contents, checking similarity to other works, and carry out a proper citation of previous works. The committee is not responsible of this previous aspects in this publishing modality. In this sense, we strongly recommend the authors to use online text-similarity checking services to avoid any form of plagiarism or copyright violation. Some workshops in this conference series use specialized services to checked for possible text similarity. For instance, MODEC is using the official account of their organizing university for URKUND web server. Please, be aware that the authors may be requested to modify (re-write their texts) the communication in the case that high similarity is detected and reported to the committee. In these cases, the manuscript could temporarily withdrawn until the authors re-submit the proper version. The authors are also allowed to submit short reviews, comments, letters, or discussions of papers already published if they guarantee sufficient difference to previous public contents.

Workshop Chairperson

Dr. Aliuska Duardo-Sanchez (Law.Lic., Ph.D. Legal Informatics)

Post-Doctoral Research Associate, Program Juan de La Cierva (JdC), Research Group: Chair in Law and The Human Genome, Department of Public Law, University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain. Email: [email protected]

Honor Advisory Committee

Prof. Carlos María Romeo Casabona

Full Professor University, Director of Research Group: Chair in Law and The Human Genome, Department of Public Law, University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain.
Member of The European Group on Ethics in Science and New Technologies (EGE), Brussels, Belgium.
Member of The Council of Europe Steering Committee on Bioethics (CDBI), Strasbourg, France.
Email: [email protected]

Prof. Frank Pasquale

Professor of Law, University of Maryland Francis King Carey School of Law, Baltimore, MD, USA.
JD, Yale Law School; MPhil, Oxford University; BA, Harvard University, Summa cum laude,
E-mail: [email protected]

Prof. Antonio López Díaz

Department of Special Public Law, Faculty of Law, University of Santiago de Compostela (USC), Spain.
Email: [email protected]

Prof. Cesar García Novoa

Department of Special Public Law, Faculty of Law, University of Santiago de Compostela (USC), Spain.
E-mail: [email protected]

Prof. Ma Begoña Villaverde Gomez

Consellera de Contas da Xunta de Galicia (Minister of Auditors of Galicia Goverment)
Department of Special Public Law, University of Santiago de Compostela (USC), Spain.

Prof. Daniel Berzosa López

Senior Manager Public Law Area, Chavarri Abogados, Professor of Constitutional and Economic Public Law. CUNEF. Madrid. Professor of Constitutional Law. IEB. Madrid. Associate Professor at the Legal Department. IE Business & Law Schools. Madrid.

Headquarters Institutional Committee

Prof. Dr. Mª Pilar Nicolás Jiménez (Faculty Vice Dean)

Vice Dean Coordinator of the Faculty of Law in Biscay, Senior Resercher, Research Group: Chair in Law and The Human Genome, Department of Public Law, University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain. Emails: [email protected]

Scientific Advisory Committee (Abroad)

Prof. Guillermo Velasco Fabra (Commercial Law)

Professor of Commercial Law, Director/Coordinator of Department/Area II Degree in Law,
CUNEF - University College of Financial Studies, Complutense University of Madrid (UCM)
Associate Lawyer, Commercial Law Area, Deloitte Abogados y Asesores Tributarios.
Codirector of the Journal Fiscalidad Internacional y Negocios Internacionales (Aranzadi)

Prof. Marcos Almeida (Public Law)

Director of the Observatory for Regulation of Public Entities. Professor and Secretary of Department of Public Law,
University of Santiago de Compostela (USC), Spain.

Prof. Josefina Chinea Guevara (Family Law)

Coordinator of Postgraduate Education, Universidad Andina Simón Bolívar, Cochabamba, Bolivia.

Ph.D. Vanessa Aguiar Pulido (Computational Sciences)

Postdoctoral Associate, Brain and Mind Research Institute (WCMC),
Weill Cornell Medicine, Cornell University, New York, 10065, USA.

Prof. Juan A. Lecaros Urzua (Law & Bioecthics)

Professor Universidad del Desarrollo (UDD), Santiago de Chile, Chile
Director Observatorio de Bioética y Derecho, Santiago de Chile, Chile

Lic. Dainerys Hernádez-Valle (Phsycology & Society)

Counseling Phsycologist, 101Y00000X , 701 SW 27TH AVE, 33135, Miami, FL , USA.

Scientific Committee (Local)

Prof. Dr. Iñigo de Miguel Beriain

Postdoctoral Research Associate, Research Group: Chair in Law and The Human Genome, Department of Public Law, University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain.
Lecturer at The National Distance Education University (UNED), Biscay, Spain.
E-mail: [email protected]

Dr. Emilio José Armaza Armaza

Lecturer of Criminal Law, Tenured-Track Researcher of Ramon y Cajal (RyC) Program, Erasmus Mobility Coordinator,
School of Law, University of Deusto, Bilbao, Spain. E-mail: [email protected], [email protected]

Prof. Dr. Susana Serrano Gazteluurrutia

Department of Public Law, Faculty of Law, University of the Basque Country UPV/EHU, Campus Biscay, Leioa 48940, Spain. Email: [email protected]

Dr. Elena Atienza Macías

(1) Visiting Fellow Basque Government, University of Coimbra, Faculty of Law, Centre for Biomedical Law
Pátio da Universidade 3005 - 545 Coimbra, Portugal. (2) Post-Doctoral Researcher, Research Group: Chair in Law and The Human Genome, Department of Public Law, University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain. E-mail: [email protected]

Lic. Iker Conal

Predoctoral Fellow, Research Group: Chair in Law and The Human Genome, Department of Public Law,
University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa 48940, Spain.

Session Chairs

Ms. Aliuska Duardo-Sanchez

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09. SIUSCI-01: San Ignacio University Sciences Workshop, SIU, Miami,USA, 2017

SIUSCI-01

[SUBMIT HERE] (Select MOL2NET Conference, Section SIUSCI)

Dear colleagues worldwide,

We are glad to invite you to participate in the workshop SIUSCI-01. SIUSCI-01 workshop series will be held at San Ignacio University (SIU), FL, Miami, USA. San Ignacio University is an innovative educational institution dedicated to the creation of the leaders of tomorrow accredited by the Accrediting Council for Independent Colleges and Schools (ACICS). The present workshop focus on topics of multidisciplinary sciences relevant to the interests of SIU students and professors. SIUSCI-01 is also devoted to strength the collaborations and networking between SIU professors and students with other students and researchers in FL education system and worldwide.

In this sense, SIUSci-01 is a workshop associated to and hosted online by the MOL2NET Conference Series on Multidisciplinary Sciences, MDPI Sciforum, Basel Switzerland. This means that all communications are going to be published online at Sciforum platform. All presentations will be peer reviewed and a DOI number will be assigned. MOL2NET conference of Sciforum is one of the platforms internationally recognized for scientific exchange. This annual edition is full of diversity in topics, approaches, and integration of disciplines, representing one of the common paradigms of modern science, interdisciplinary teamwork, and networking. I hope you will enjoy the program and the presentations.

Publication Model and Authors Responsibility:

Chairperson:

Prof. Lazaro Pino, Email: [email protected] (MOL2NET Scientific Committee)
Professor San Ignacio University (SIU), Campus Miami, FL, Miami, USA.
Associate Professor, West Coast University (WCU), Miami, FL, USA.
Adjunct Professor, Miami Dade College (MDC), Miami, FL, USA.

Scientific Committee

Prof. Maykel Cruz Monteagudo, FCT Fellow, Univ. of Porto; Consultant, Univ. of Miami, Prof. West Coast University, FL, USA.

Prof. Xiomara Cabrera, San Ignacio University (SIU), Campus Miami, FL, Miami, USA.

Prof. Tania Sureda, Miami Dade College (MDC), Miami, FL, USA.

Ph.D. Aliuska Duardo-Sanchez (Law.Lic., Ph.D. Legal Informatics)
Post-Doctoral Research Associate, Program Juan de La Cierva (JdC), Department of Public Law,
University of Basque Country (UPV/EHU), Faculty of Law, Campus Biscay, Leioa, 48940, Spain.

Advisory Chair:

Prof. González-Díaz H., IKERBASQUE Professor, Email: [email protected]

(1) Department of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Spain.

(2) IKERBASQUE, Basque Foundation for Science , 48011, Bilbao, Biscay, Spain.

ORCID: https://orcid.org/0000-0002-9392-2797

Session Chairs

Dr. Lazaro Pino

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10. EJIBCE-01; Meeting of Young Researchers in Structural Computational Biology, UC, Coimbra, Portugal, 2017

EIJCBE-01

[REGISTER/LOG IN TO SUBMIT NEW ABSTRACT OR COMMUNICATION HERE]

About

The Meeting of Young Researchers in Structural Computational Biology (EJIBCE 2017) aims at bringing together the Portuguese scientific community working in the field in a free-of-charge meeting, to provide a forum for discussion and sharing with no strings attached. This third edition builds on the success of previous editions in Porto, Lisbon, Coimbra and Oeiras, which gathered ca. 60 participants and had over 10 oral communications in each edition.

Mission & Objectives

Given the current economic situation in Europe, and particulaly in Portugal, it is increasingly harder to obtain funding and have an optimistic approach to science and collaborations. Besides, the recent austerity measures put in place by the Portuguese government led many researchers to join groups and institutes abroad, and eventually lose touch with the Portuguese scientific community and developments.

After obtaining a doctoral degree or finishing a postdoctoral appointment, many Portuguese scientists abroad look back to their country looking for an opportunity to continue their careers and contribute to the development of Portuguese science. Others wish to remain abroad, but at the same time reach out to the Portuguese community and cultivate stronger ties to its researchers. However, what groups are there on Computational Structural Biology? What do they actually focus on? Are they open to collaborations?

This meeting was created in order to answer these and other similar questions. Its main goal is to provide a simple no-frills environment where Portuguese researchers in Computational Structural Biology, active both in Portugal and abroad, can meet and get to know each other’s research and ambitions. Ultimately, we hope that in doing so, we will be able to stimulate new collaborations and broaden the horizons of the Portuguese community of Computational Structural Biologists.

EJIBCE 2017

EJIBCE 2017 builds up on the format of previous editions, focusing on a small number of oral communications interspersed with several breaks to encourage discussion and exchange of ideas. Throughout the day, 11 researchers will present their results. Seven will be selected from the submitted abstracts by the Scientific Committee, based on the quality and originality of the work, and will be given 15 minutes to speak, followed by a short discussion. The remaining 4 oral communications will be delivered by invited keynotes, who will be given 30 minutes to speak plus 10 for discussion. The program is available as a Google Calendar [Here].

This workshop is associated to the MOL2NET-03 International Conference Series on Multidisciplinary Sciences. This is a year-round conference series with multiple associated workshops worldwide (online and in person). In fact, This year’s edition will run both, in person at University of Coimbra Physic’s Department and online at the web platform SciForum maintained by the editorial MDPI, Basel, Switzerland. It means that, after publication of all papers of all the workshops associated to the conference we shall open the online platform and the authors of general sections and all workshops will be able to post online comments and/or answers to comments in this workshop/section and also in the other general sections and/or workshops. To see a detailed schedule of the conference follow this link [MOL2NET workshops schedule].

Guest Speakers

João Ribeiro received his diploma degree in Bioinformatics in 2009 from the Faculty of Biotechnology, Portuguese Catholic University, and his Ph.D. in Sustainable Chemistry in 2014 from the Faculty of Science, the Faculty of Pharmacy and the Institute of Biomedical Sciences Abel Salazar of University of Porto in association with the Nova Lisboa University, advised by Prof. Maria J. Ramos. During his Bioinformatics degree, he had the opportunity to combine Biology and Biochemistry with software development to produce user-friendly Bioinformatics tools. The pursuit for the integration of Biochemistry and software development followed João to his Ph.D studies, where he developed third-party tools (plugins) for the widely used molecular visualization program VMD, developed by Klaus Schulten’s Theoretical and Computational Biophysics (TCB) group. These plugins aimed to assist non-expert users of Computational Chemistry software at different stages of the computer-aided drug design process, such as molecular docking, protein mutagenesis and molecular dynamics simulation analysis. João joined the TCB group in 2014 to employ molecular dynamics simulation to study the cellulose degradation process for biofuel production while keeping the software development always present in his work. He is currently the main developer of the newest VMD plugin to assist MD novice users in the preparation, execution and analysis of MD simulations, QwikMD. This plugin smooths the initial learning curve imposed by the MD programs and allows more advanced users to speed-up tedious structure preparation procedures.

João M. Damas is a biochemist from background (Universidade de Lisboa, 2007) that decided to follow computational molecular biophysics. During more than eight years he was a researcher in the Protein Modelling laboratory (www.itqb.unl.pt/pm), under the supervision of Prof. Cláudio M. Soares, where he specialized in molecular dynamics and related techniques and applying them to understanding biomolecules at the molecular level. One year and a half ago, João joined Acellera Ltd. (www.acellera.com), a company focused on software and hardware solutions for computerized drug discovery, where he is a Researcher and Software Developer. He is one of the main developers and maintainers of HTMD, a Python package to prepare, handle, simulate, visualize and analyze molecular systems, as well as of other Acellera software, such as ACEMD, AceCloud, and AceFlow.

António Ribeiro is a postdoctoral researcher in bioinformatics and computational chemistry at the European Bioinformatics Institute (EBI), in Cambridge. António finished his biochemistry master’s degree in 2009 at the Faculty of Sciences of the University of Porto. His master thesis was developed in the computational biochemistry group under the supervision of Professors Maria João Ramos and Pedro Fernandes, and focused on the application of computational methods (QM and QM/MM) to study chemical and enzymatic reactions. His PhD thesis, finished in 2013, was done in part at the same group, but also at the University of Calabria, with Professor Nino Russo. The thesis described the computational study of the catalytic mechanism of several enzymes, namely HIV-1 Integrase and Protein Phosphatase 5. After the PhD, António used other computational methods like virtual screening and free energy calculations to identify potential hit compounds for HIV-1 Integrase. Since June, 2016, he is part of Professor Janet Thornton’s group at the EBI, where he is developing a database of enzyme mechanisms and catalytic sites. This database (https://www.ebi.ac.uk/thornton-srv/m-csa/) will be used to understand enzymatic function and enzyme evolution.

João M. Martins graduated with a Bachelor’s degree in Chemistry with the University of Porto in 2011, having started his work in computational structural biology during his undergraduate studies. He later obtained the degree of master in Chemistry from the same university, researching quantum chemistry and theoretical structural biology during his Master’s thesis work. Working under Prof. Kresten Lindorff-Larsen, he obtained the PhD degree in Biochemistry in 2017 with the Structural Biology and NMR lab (SBiNLab) of the University of Copenhagen. His work has been focused on protein-protein interfaces, hotspot theory and small molecule docking under the supervision of Irina Moreira while at the University of Porto and mutation studies through free energy perturbation and integration of experimental data in protein simulation. Currently, he works as a postdoctoral research scientist at the The Image Section of the University of Copenhagen computer science department. His research focuses on protein structure and function studies through machine learning and neural networks’ methods.

Statement of Responsibility

All materials and services on this website are provided without warranties. The content published in these pages may contain errors for which the organization assumes no liability or responsibility. The content is also subject to periodic changes without the duty of notice. Any doubts and questions should be addressed to the organization by email ([email protected]). Registration to this event implies acceptance of these conditions.

Chairpersons

Irina Moreira, E-mail: [email protected]
Center for Neuroscience and Cell Biology (CNC)
Universidade de Coimbra, Coimbra, Portugal;
Bijvoet Center for Biomolecular Research,
Faculty of Science-Chemistry, Utrecht University,
Utrecht, The Netherlands.
http://orcid.org/0000-0003-2970-5250

Rita Melo, Email: [email protected]
Center for Neuroscience and Cell Biology and
Center for Nuclear Sciences and Technologies (CNC)

Organizing Committee

Cândida Silva, CQC

Carlos Simões, BSIM²

António Preto, CNC

José Almeida, EBI

Carlos Barreto, CNC

Alexandra Carvalho, CNC

Pedro Filipe, UC

Scientific Committee

Ozge Sensoy, Medipol - Istambul, Turkey

Giulia Morra, ICRM - Milan, Italy

Marcel Swart, IQCC - Girona, Spain

Advisory Chairman (Online Publication)

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11. EHUDW-01: First EHU-DELFIN Programme Workshop, UPV/EHU, Bilbao, Spain, 2017

EHUDW-01: First EHU-DELFIN Programme Workshop, Bilbao, Jul, 2017

The UPVEHUDW01: First UPV-EHU DELFIN Program Workshop, Bilbao, Jul, 2017 is a scientific and educational workshop organized by professors of the University of the Basque Country (UPV/EHU) and IKERBASQUE, Basque Foundation for Sciences. The workshops is associated to the MOL2NET International Conference Series on Multidisciplinary Sciences, MDPI Sciforum, Basel, Switzerland.

The workshop aim is to promote the scientific, educational, and cultural interchange of professors and students of UPV/EHU with students of the international education network DELFIN, Mexico. The DELFIN program was created in 1995 with the aim of strengthening the collaborative culture between the Higher Education Institutions and Research Centers that are members of the Program, through the mobility of professors-researchers, students and the dissemination of scientific and technological products. In particular to strengthen the development of research and national graduate.

Specifically, student mobility is promoted through academic research stays, within the framework of the Summer of Scientific and Technological Research of the Pacific. This mobility program strengthens the vocation of young people for science and technology and influences their decision to join postgraduate programs at home and abroad.

EHUDW-01 Steering Committee

Prof. Dr. Susana Serrano Gazteluurrutia, Email: [email protected]
Department of Public Law, Faculty of Law, University of the Basque Country UPV/EHU, Campus Biscay

Prof. Dr. Guillermo Quindós, Email: [email protected],
Department of Immunology, Microbiology, and Parasitology, University of the Basque Country UPV/EHU, Campus Biscay

Prof. Dr. Elena Eraso Barrio, Email: [email protected],
Department of Immunology, Microbiology, and Parasitology, University of the Basque Country UPV/EHU, Campus Biscay

Dr. Aliuska Duardo Sánchez, Email: [email protected] (Online Publication Coordinator)
Research Group: Chair of Law and Human Genome, Department of Public Law
Faculty of Law, University of the Basque Country UPV/EHU, Campus Biscay.

Prof. Dr. Sonia Arrasate, Email: [email protected]Department of Organic Chemistry II, University of Basque Country (UPV/EHU), Campus Biscay

Advisory Committee (UPV/EHU)

Department of Immunology, Microbiology, and Parasitology

Andrea Guridi Cortaberria
Katherine Miranda Cadenas
Lucila Madariaga Torres
Cristina Marcos Arias
Estibaliz Mateo Alesanco
Rosario San Millán Gutiérrez
Elena Sevillano Peña

Department of Odontology II

José Manuel Aguirre Urizar
Eduardo Ginestal Gómez

Department of Pharmacology

Nerea Jauregizar Albonigamayor

Session Chairs

Ms. Aliuska Duardo-Sanchez

Dr. Esvieta Tenorio-Borroto

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12. MODEC-02: Workshop on Natural Products and Agro-Industrial Procesess in Amazon, UEA, Puyo, Ecuador, 2017

MODEC, 2nd Edition

[Workshop Editorial & Full Committee]

MODEC 2017 (Submissions Open)

SUBMIT TO MODEC HERE!!!

NOTE ON PUBLICATION MODEL: Before to submit your work be aware that the editorial publication model of this workshop is similar to a PREPRINT service. It means that works presented here have to be considered only as preliminary communications and not as final post-print versions of journal papers. In this sense, even when all the works published are revised by at least one member of the committee and/or external reviewer this level of revision checks only apparent scientific soundness and general scientific interest. In a second level, collective post-publication review, the works published may receive comments (published in the form of posts) from all the participants registered in the conference. The authors are prompted to use all these opinions to write the full versions of their works and submit them to publication in a peer-reviewed scientific journals according to SciForum copyright rules. In the specific case of MODEC workshop all papers will be checked for possible similarity using the official count of the organizing university for URKUND web server. In any case, the authors are the only one responsible of the veracity of the contents, checking similarity to other works, citing properly previous works, etc.

MODEC2017, International Workshop on the Natural Products and Agro-Industrial Processes in Ecuadorian Amazon region

Welcome to the MODEC2017 workshop. This is Amazon State University's (UEA) first workshop, devoted to the promotion and application of the Multidisciplinary Sciences to the development of natural products and agro-industrial processes in Ecuadorian Amazon regions.

This workshop runs both online and on location at the university. The online portion of the workshop is powered by the SciForum platform of MDPI, hosted by the MOL2NET International Conference Series on Interdisciplinary Sciences.

Additionally, the physical component of the workshop is also scheduled to run through the Department of Earth Sciences (Facultad de Ciencias de la Tierra) at Universidad Estatal Amazónica (UEA), Puyo, Ecuador. Please, contact the workshop chairmen for further details. Paper submission is already open and the publication of papers for conference purposes in SciForum platform is free of cost.

Publications are expected to be short papers consisting of 1-3 pages. Be aware that the submission is a two step process. First you must register and submit a tentative title, authors list and abstract. Next, you need to submit your full publication upon acceptance of the abstract by the committee. Full publications will be published online, free of charge, with doi number as soon as possible after acceptance. If you are planning to submit a publication, please use the following template, MODEC Template.doc. Click on the following link to register and/or submit your communication Sumit to MODEC here.

All submitted papers should fall under one of the following categories:

Computational chemistry, Cheminformatics, and Bioinformatics
Mathematical modeling
Organic and Functional Foods
BioTrade: Natural Products of the Amazon
Production systems with agro-business and forestry purposes or biomass for energy purposes
Environmental impacts
Agro-industrial development processes

Schedule:

Abstracts submission until 2017-Oct-01, Envio de los abstract hasta el 01 de octubre de 2017.
Abstract acceptance until 2017-Oct-03.
Communications submission until 2017-Nov-01.
Communications acceptance until 2017-Nov-15.
Communications publication until 2017-Nov-30.

Please, click the following link to read the editorial paper with welcome message and call for papers as well as the full description of the workshop with details of topic, short biographies of the members of the committee, contact details, personal pictures, etc., [Workshop Editorial & Full Committee]

Chairperson

Prof. Amaury Pérez Martínez received his Bs. in Chemical Engineering in 2002, his MSc degree in Chemical Engineering Processes and Analysis in 2007, and his PhD degree in Chemical Engineering in 2013. He has worked in the development of new technology in the Chemical Industry. Currently, he is an Assistant Professor of Agro industrial Engineering at Amazon State University (UEA) in Puyo, Ecuador. His research interests include philosophy of process design, simulation, and sustainable development

Institution: Universidad Estatal Amazónica, Ecuador

Email: [email protected]

Honoray Chairman

Prof. Dr. C. Julius Caesar Vargas Burgos, Full Professor and Rector of Amazon State University (UEA), Puyo, Ecuador

Session Chairs

Dr. Amaury Perez Martinez

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13. WRSAMC-02: Workshop in Medicinal Chemistry, UFPB, Paraiba, Brasil, 2017

WRSAMC2017, 2nd Edition

NOTES: Before to submit your communication we strongly recommend to read carefully the [Notes to Authors] about, participation modalities, publication model, copyright, authors responsibilities, etc.

Submit new abstract

[MOL2NET Homepage] [Honor Committee] [Co-Chairs Committee] [Scientific Committee (Abroad)] [Scientific Committee (Local)]

NOTES: MOL2NET is a year-round conference series with multiple associate workshops worldwide. As is the conference is running and open to submissions almost all the year, please read [Workshops/Sections Schedule]. We suggest you to download and use the [Template File] to write your communication. We also strongly recommend you to read carefully the [Instructions to authors] about publication model, copyright, authors responsibilities, etc.

[Facebook] [2015] [2016] [Welcome Videos] [Mandarin, 官话 ] [Hindi, हिन्दी] [Euskera] [Castellano] [Português] [Français]

Welcome Message from Chairs

Dear all we are glad to welcome you to the workshop in research sciences applied in medicinal chemistry 2017, organized by researches from Department of Chemistry, Programa de Pós-Graduação em Produtos Naturais e Sintéticos Bioativos (PgPNSB - Postgraduate Program in Natural Products and Synthetic Bioactive) and Hospital Universitário of Universidade Federal da Paraíba (UFPB). This year the WRSAMC is dedicate to the PgPNSB 40th Anniversary.

This is workshop also is associated to MOL2NET-2 International Conference on Multidisciplinary Sciences. Consequently, the present page of the conference will serve as both: (1) publication media for communications, posters, or plenary conferences (videos) and also (2) online discussion media to post comments, questions, and answers about the workshops, respectively. Participants on both events, online discussions at the end of the year and workshop along the year, are entitled to receive attendance certificates from both the WRSAMC workshop and the MOL2NET conference. The WRSAMC will be held from 11-14 December 2017, online via the platform SciForum.
The online submission is now open and the publication of communications will be ASAP after acceptance.

Abstract/Paper submission until: December 4, 2017

Paper acceptance until: December 5, 2017

Notes to Participants

Submission process has the following steps: 1-Registration, 2-Submission of abstract, 3-Wait for abstract acceptation email, 4-Upoload of full communication, 5-Wait for communication approval/publication emails. After you successfully register, you can submit your paper online. Communications are expected to be short papers 1-3 pages. Please, donwload and use the following template WRSAMC template to submit your communication.

Be aware:

on step 1, you should select MOL2NET 2017, International Conference on Multidisciplinary Sciences, 3rd edition (Conference).

on step 2, you should select WSRAMC2017 workshop in research sciences applied in medicinal chemistry.

Before to submit your work be aware that the editorial publication model of this workshop is similar to a PREPRINT service. It means that works presented here have to be considered only as preliminary communications and not as final post-print versions of journal papers. In this sense, even when all the works published are revised by at least one member of the committee and/or external reviewer this level of revision checks only apparent scientific soundness and general scientific interest.

In a second level, collective post-publication review, the works published may receive comments (published in the form of posts) from all the participants registered in the conference. The authors are prompted to use all these opinions to write the full versions of their works and submit them to publication in a peer-reviewed scientific journals according to SciForum copyright rules. Some workshops will use specialized services to checked for possible similarity. In any case, the authors are the only one responsible for the veracity of the contents, checking similarity to other works, and proper citing or under-citing of previous works, etc.

Workshop Chairs

Prof. Marcus Tullius Scotti, Departamento de Química, Centro de Ciências Exatas e da Natureza, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900 João Pessoa - Paraíba - Brasil, Emails: [email protected], [email protected]

Prof. Luciana Scotti, Hospital Universitário, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba - Brasil. Emails: [email protected]

Scientific Committee

Prof. Francisco Jaime Bezerra Mendonça Junior, Centro de Ciências Biológicas e Sociais Aplicadas, Universidade Estadual da Paraíba, Campus V - João Pessoa. Rua Horácio Trajano de Oliveira s/n, CEP>, 58020540 - João Pessoa, Paraíba – Brasil

Prof. JoseanFechine Tavares, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

Prof. Fabiana de Andrade Cavalcante Oliveira, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

Prof. BagnoliaAraujo Costa, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

Prof. Mateus Feitosa Alves, Departamento de Ciências Farmacêuticas, Centro de Ciências da Saúde, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900 João Pessoa - Paraíba – Brasil.

Prof. Vicente Carlos de Oliveira Costa, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

M.Sc. Lucas Silva Abreu, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

M.Sc. Yuri Mangueira Do Nascimento, Instituto de Pesquisa em Farmacos e Medicamentos, Universidade Federal da Paraíba - Campus I, Cidade Universitária, CEP: 58.051-900, João Pessoa - Paraíba – Brasil.

Advisory Chairman

Session Chairs

Professor Marcus Scotti, Federal University of Paraíba

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14. UCHCEUW-14: 14th UCH-CEU Workshop on Multidisciplinary Sciences, UCH, Valencia, Spain, 2017

UCHW01: UCH Workshop on Multidisciplinary Sciences, Valencia, Spain, 2017

SUBMIT TO THIS WORKSHOP

Dear all we are glad to welcome you to the WUCH01: UCH Workshop Series on Multidisciplinary Sciences, Valencia, Spain, 1st edition. This is one scientific conference series for professors, researchers, and young scientists; with special emphasis on the active participation of graduated students of the CEU Cardinal Herrera University (UCH), Valencia, Spain. The main source of papers of this workshop are the results presented by the professors and students of the UCH on their 14th Students International Congress. This congress was hold in person on July 2016 at UCH, Montcada, Valencia, Spain.

However, the workshop also welcomes online participation (posts) and/or submissions (2-3 pages long communications) from all colleagues worldwide to be published online. The submission is open and the publication of communications will be ASAP after acceptance, all the year; to submit a communication use the Submission link. After you successfully register, you can submit your paper online. You need to register and send your abstract first. For more details please contact the chairperson of this workshop by email. This is workshop is associated to MOL2NET-03 International Conference on Multidisciplinary Sciences, MDPI Sciforum, Switzerland, HQ UPV/EHU, Bilbao, Spain.

Be aware:

on step 1, you should select MOL2NET 2017, International Conference Series on Multidisciplinary Sciences, 3rd edition

on step 2, you should select Section: UCHW01: UCH Workshop on Multidisciplinary Sciences

Publication Model and Authors Responsibility:

Steering Committee

Online Workshop Chairperson:

Prof. María Auxiliadora Dea Ayuela
Department of Pharmacy, Coordinadora de Titulación de Grado, Grado en Nutrición Humana y Dietética - Seminario Salud Avda. Seminario s/n. 46113 Moncada - Valencia, Telf. 96 136 90 00 | Ext. 61572, Email: [email protected]

Institutional Chairpersons:

Dª. Mª José González Solaz, Vicerrectora de Estudiantes y Vida Universitaria
D. Ignacio Pérez Roger, Vicerrector de Investigación

Organizing Committee

Dª. Ruth Abril Stoffels
Dª. Sara Barquero Pérez
Dª. Milagros Benito Hernández
Dª. Sonia Cervera Estela
D. Benjamin Dieu
Dª. Mª Auxiliadora Dea Ayuela
D. José Luis del Amo Naranjo
Dª. Mª Rosario García Bellido
D. Javier García Gramaje
D. Alberto Giménez Sancho
Dª. Sara Gómez Gázquez
Dª. Sara González Sánchez
Dª. Mariam Ibáñez Company
Dª. Marina Leal Clavel
Dª. Arlinda Luzi Luzi
Dª. Esmeralda Martínez Argilés
Dª. Mª Teresa Mercado Sáez
D. Enric Poch Jiménez
Dª. Isabel Serra Guillén
D. Chirag Charndrakant Sheth Shah
Dª. Aloma Tadea Mayordomo Febrer
Dª. Laura Valls Navarro
Dª. María Amparo Vila Caballer

Scientific Committee

MEDICINE
 Mariam Ibáñez Company
 María Amparo Vila Caballer
 Rosa Lopez Pedrajas
 Paula Sanchez Thevenet
 Jose Antonio Costa Muñoz
 Antonio Rafael Barrasa Shaw
 Verónica Veses Jiménez
 Gonzalo Rafael Haro Cortés
 Desamparados Navea Tejerina
 José Vicente Amaya Valero
 María Aracely Calatayud Pascual

PHARMACEUTICAL SCIENCES
 María Auxiliadora Dea Ayuela
 Enric Poch Jiménez
 Marta Marín Vázquez
 Isabel Guillen Salazar
 Pedro Alemán López
 Lourdes Bosch Juan
 Mª Dolores Guerrero Masiá
 Antonio Blanquer Hernández
 Eugenia González Rosende
 José Vicente García Matero

NURSING
 Isabel Serra Guillén
 Jose Vicente Carmona Simarro
 Carmen Trull Ahuir
 Marina Leal Clavel
 Carmen Rocamora Rodríguez
 Noelia Rodriguez Blanco
 Loreto Peyró Gregori
 Elena María Esteve López

ODONTOLOGY
 Arlinda Luzi Luzi
 Chirag Charndrakant Sheth Shah
 Salvatore Sauro
 Marta Ribelles Llop
 Raquel González Martínez
 Juan Manuel Nuñez Martí
 Pablo Fos Galve
 Mar Jovani Sancho
 María Clara Furió Sabater

VETERINARY MEDICINE
 Milagros Benito Hernández
 Aloma Mayordomo Febrer
 Begoña Ballester Lurbe
 David Viana Martín
 Empar García Roselló
 Mª Estrella Jiménez Trigos
 Jaume Jordá Vicent
 Milagros Mateos Otero
 Jesús Cardells Peris
 Ángel Hernández Guerra
 Jordi López Ramón
 Katiuska Satué Ambrojo
 María López Murcia
 Jon Romero Aguirregomezcorta

PHYSIOTHERAPY
 Javier Martinez Gramage
 Pablo Salvador Coloma
 Gemma Biviá Roig
 Vicente Benavent Caballer

LAW, POLITICAL SCIENCES, AND BUSINESS
 Ruth Abril Stoffels
 Maria Pilar García Alcober
 Marta Pérez Gabaldón
 Juan Martínez Otero
 Francisco Suay Pérez

JOURNALISM, MARKETING, PUBLICITY, COMMUNICATIONS
 Maite Mercado Sáez
 Mª Pilar Paricio Esteban
 Begoña Siles Ojeda
 Ángel Javier Castaños Martínez
 María José Pou Amérigo

EDUCATION
 María Rosario García Bellido
 Fernando Serrano Pelegrí
 Margarita Fernández Romero
 Francisco Pardo Fabregat
 Ana Elisa Esteve Pastor
 Enrique Cerezo Herrero
 Néstor Alonso Villodre
 Santiago Celestino Pérez Jiménez
 Jacobo Nogueruela Avellà
 Helena María Pascual Ochando
 Mónica Belda Torrijos
 Jaime Vilarroig Martín
 Carmen María Muñoz Herrera
 Núria Andreu Ato
 Alberto Zapatera Llinares

ESET
 Alberto Giménez Sancho
 Alfonso Diaz Segura
 Sara Barquero Pérez
 Pedro Verdejo Gimeno
 Teresa Ferrer Dasí

Session Chairs

Dr. Maria Auxiliadora Dea-Ayuela

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* This conference is managed by external organizers. Sciforum is not responsible for the content posted on this website.

MOL2NET 2017, International Conference on Multidisciplinary Sciences, 3rd edition

15/01/2017 - 15/12/2017

Welcome from the Chairs

MOL2NET Sponsors

Conference Chairs

Sessions

Instructions for Authors

List of accepted submissions (174)

List of Authors (488)

Honor Advisory Committee

Scientific Committee (Abroad)

Presidents of the Abroad Scientific Committee

Abroad Scientific Committee (North America)

Members of Scientific Committee (Europe)

Members of Scientific Committee (Other Regions)

Scientific Committee (Local)

Coordinator Scientific Committee (Neurosciences)

Scientific Committee Members

Scientific Committee Members (UPV/EHU)

Co-Chairs Committee

Co-Chairs (Theoretical Sciences)

Dr. S.C. Basak,

Headquarters & Institutional Co-Chairs

JCR Journals Special Issues

Nanomaterials

International Journal of Molecular Sciences

Workshops/Sections Schedule

MOL2NET Workshops/Sections Schedule

Notes on Topics

About This Conference

IKERBASQUE Committee

00. Editorial & Proceedings Book

Welcome Message

MOL2NET Sponsors

Submissions

01. Chemistry (All Areas), Soft Matter Physics, Pharmaceutical Sciences, Polymer, and Nanosciences

Submissions

02. OMICs, Biotechnology, Bioinformatics, Neurosciences, and Biomedical Engineering

Submissions

03. Computational Sciences, Statistics, Artificial Intelligence, Complex Networks, Machine Learning, and Big Data

Submissions

04. SRI-09: 9th Summer Research Institute Symposium, STU-MDC, Miami, USA, 2017

Welcome Message

SRI Chairman

Scientific Committee

Advisory Committee

Advisory Chair

Submissions

05. WCUCW-01 West Coast University Capstone Workshop, WCU, Miami, USA, 2017

Steps for Participation

Notes to Participants

Steering Committee (Chairpersons)

Advisory Scientific Committee

Submissions

06. USINEWS-01; US-IN-EU Worldwide Science Workshop Series, UMN, Duluth, USA, 2017.

Submissions

07. IWIMSM-01: Iberoamerican Workshop on Modelization and Simulation, UCV, Valencia, Spain, 2017

Welcome Message

Scope and Target Audience

Abstract preparation and submission

Steps for Participation

Steering Committee (Chairpersons)

Scientific Committee (Local)

Scientific Committee (Abroad)

Submissions

08. LAWSCI-01: Challenges in Law, Technology, Life, and Social Sciences, UPV/EHU, Bilbao, Spain, 2017

Workshop Chairperson

Dr. Aliuska Duardo-Sanchez (Law.Lic., Ph.D. Legal Informatics)

Honor Advisory Committee

Headquarters Institutional Committee

Prof. Dr. Mª Pilar Nicolás Jiménez (Faculty Vice Dean)

Scientific Advisory Committee (Abroad)

Prof. Guillermo Velasco Fabra (Commercial Law)

Prof. Marcos Almeida (Public Law)

Prof. Josefina Chinea Guevara (Family Law)

Ph.D. Vanessa Aguiar Pulido (Computational Sciences)

Prof. Juan A. Lecaros Urzua (Law & Bioecthics)

Lic. Dainerys Hernádez-Valle (Phsycology & Society)

Scientific Committee (Local)

Lic. Iker Conal

Irina Moreira, E-mail: [email protected]
Center for Neuroscience and Cell Biology (CNC)
Universidade de Coimbra, Coimbra, Portugal;
Bijvoet Center for Biomolecular Research,
Faculty of Science-Chemistry, Utrecht University,
Utrecht, The Netherlands.
http://orcid.org/0000-0003-2970-5250