CATCH4HIT the MOL2NET Academy-Industry Advisory Committee

CEO, CIO, R&D Directors, Officers, Consultants, Researchers from
SME, Industry, Funding Institutions, Technological Centers

Committee aims. MOL2NET conference is specially interesting on promoting academy-industry collaboration. This may in turn increase society returns by means of translational research in chemistry, nanotechnology, biotechnology, bench-to-bed investigation in medicinal sciences and biomedical engineering, etc. Consequently, we have created this committee of scientific directors of university departments and technological centers along with CEO, CIO, and R&D directors from SME and Technological Companies. We also welcome industry consultants, policy makers, SME-Industry funding institutions staff, and all people related to Academy-Industry collaboration work. We specially welcome new members to join us. Please, do not hesitate to contact the chairperson to propose a collaboration by yourself or appoint some colleague. One of the aims of the committee is the creation of the homonym CATCH4HIT congress series in the conference to fostering Academy-Industry collaborations.

Scientific scope. As the congress is linked to MOL2NET conference the main emphasis is in Research & Development (R&D) in Experimental Molecular Sciences and Biomedical Engineering on one hand and New Technologies and Computational Sciences on the other (see topics bellow). The scientific scope of the committee is broad but somehow focused on experimental and computational research applied to Biomolecular industry and sciences: Medicinal Chemistry, Pharmaceutical Industry, Nanotechnology, Materials Sciences, Biotechnology, Biofuel Production, Environmental Sciences, Neurosciences, Biomedical Engineering, Medical Imaging, and related topics. Applications of Computational Sciences, Artificial Intelligence, Quantum Computing, Big Data analysis, Chemoinformatics, Bioinformatics, Complex Networks Analysis, on research and industry focused on the previous areas are also welcome. Last, all topics related to Bioethics, Regulatory Affairs, Data Protection, Patenting, Copyright, etc. on industry and research in these areas is of our interest as well. Both experts on experimental and/or computational applications on these industrial research areas are welcome.

Acronym. CATCH4HIT acronym is formed in first instance by the word CATCH abbreviation of: Congress of Academy Transference to Company for Helping to... The middle part includes the number 4 resembling the sound of the word for. The last part includes the word HIT abbreviation of: for Heighten Innovation and Technology. Both words of the acronym are and allegory to two of the more common actions in the Baseball sport (CATCH and HIT the ball). A poetic resemblance to the possibility of catching new opportunities and hit the limits in technology and innovation.

CATCH4HIT Committee members

Prof. Fernando P. Cossío, (IKERBASQUE Foundation President), Prof. Dept. of Organic Chemistry I, University of Basque Country (UPV/EHU), Donostia - San Sebastián Campus, Gipuzkoa, Basque Country, Spain.

Dr. Allen B. Reitz, Ph.D., ALS Biopharma CEO (Founder ), FCCDC CEO Fox Chase Chemical Diversity Center, Inc., Moore Fellow in the Management of Technology, Penn Engineering, Adjunct Professor at Drexel University College of Medicine, Doylestown, PA, USA.

Prof. Jerzy Leszczynski, USA Presidential Distinguished Fellow, Dept. of Chemistry and Biochemistry Interdisciplinary Center for Nanotoxicity (ICN), Jackson State University (JSU), USA.

Prof. Jesús Jimenez-Barbero, IKERBASQUE Professor, Scientific Director of Center for Cooperative Research in Biosciences (CICBiogune), Biscay, Dept. of Organic Chemistry II, UPV/EHU, Leioa, Basque Country, Spain.

Prof. Iban Ubarretxena, IKERBASQUE Professor, BIOFISIKA, Basque Center for Biophysics, Biscay Biophysics Foundation (BBF), Scientific Director, CSIC-UPVEHU, Basque Country, Spain.


Prof. María Isabel Loza, CiMUS, Vice-Director , Department of Pharmacology, University of Santiago de Compostela USC, Galicia, Spain.

Dr. Gonzalo Hernandez Herrero, FAES FARMA, Director of Research, Develop. and Innov., Leioa, Greater Bilbao, Basque Country, Spain.
Dr Ignacio Sancho-Martínez, FAES FARMA, Chief Scientific Officer, Leioa, Greater Bilbao, Basque Country, Spain.

Dr. Tatiana Suarez Cortes, FAES FARMA, Head of Research, Development and Innovation Promotion.
R&D+i Department, Leioa, Greater Bilbao, Basque Country, Spain.

Dr. Elías Unzueta Etxeita, Chief Innovation Officer (CIO), Petronor Innovación S.L., Muskiz, Greater Bilbao, Basque Country, Spain.

Prof. Alejandro Pazos, Ph.D., M.D., Chair and Director of Department of Computer Sciences, University of Coruña (UDC), Coruña, Spain. IKERDATA S.L. UDC-UPVEHU, ZITEK, President of Scientific Advisory Board, Coruña, Galicia / Leioa, Basque Country, Spain.Prof. José María Pitarke , UPV/EHU, Dir. of Nanomaterials Cooperative Research Center (CICNanoGune), San Sebastian, Basque Country, Spain.

Prof. Luis M Liz-Marzán, IKERBASQUE Professor, Scientific Director of Center for Cooperative Research in Biomaterials (CICbiomaGUNE), Gipuzkoa, Basque Country, Spain.

Prof. María José Sanz Sánchez, IKERBASQUE Prof., Scientific Director, Email address: info@bc3research.org
Basque Center for Climate Change (BC3), UPVEHU, Leioa, Basque Country, Spain.

Prof. Eddy Sotelo. Associate Professor of Medicinal Chemistry. Univ. Santiago de Compostela. Co-founder, Chairman of the Board of Directors at Celtarys Research SL New Fluorescent Tools for Pharma and Bio Research, Santiago de Compostela, Galicia, Spain.

MSc. Gorka Artola, Chief Innovation and Tech-Transfer Officer, OTRI, University of Basque Country (UPV/EHU), Basque Country, Spain.
Telf. + 946012108, Email: gorka.artola@ehu.eus

MOL2NET-IKERBASQUE Advisory Committee

Prof. Enrique Solano, Ikerbasque Prof., Ikerbasque Website, Dept. of Physical Chemistry, Univ. of the Basque Country UPV/EHU, 48080 Bilbao, Spain

Prof. Humbert González-Díaz, IKERBASQUE Professor, Email: mol2net.chair@gmail.com
(1) Dept. 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 - MDPI Journals Issues

MOL2NET - MDPI Journals Issues (Organized by MOL2NET Committee Members)

In parallel, MOL2NET conference community members have been guest editors of >20 JCR journals special issues for different journals of the editorial MDPI (https://www.mdpi.com/). Many of these special issues are 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. We welcome new proposals of special issues by other colleagues. In order to send a proposal of associated workshop and/or special issue contact the chairperson of the conference Prof. González-Díaz H. IIKERBASQUE Prof., University of the Basque Country (UPV/EHU), Biscay, Basque Country, Spain. Email: mol2net.chair@gmail.com. Please, check the following list of past and present special issues associated to our conference:

Open Journals Issues (Call For Papers)

28. Metabolites (Call For Papers): Special Issue: The Impact of Marine Chemical Pollution to Microorganism Metabolites. Journal: Metabolites (ISSN 2218-1989), JCR IF = 4.097. Editor: Prof. Marianne Graber, Laboratoire LIENSs Littoral Environnement et Sociétés, Institut écologie et environnement (IEE), French National Centre for Scientific Research (CNRS), Paris, France. Submissions until: 15-Nov-2021. Email: marianne.graber@univ-lr.fr

27. Biomolecules (Call For Papers): Special Issue: Computational Approaches for the Discovery and Development of Pharmacologically Active Natural Products. Journal: Biomolecules (ISSN 2218-273X). JCR IF = 4.082. Submission until: 28 February 2021. Editor: Prof. Jose L Medina-Franco, National Autonomous University of Mexico (UNAM), México.

26. IJMS (Call For Papers): Special Issue: Complex Networks, Bio-Molecular Systems, and Machine Learning. Journal: International Journal of Molecular Sciences IJMS (ISSN 1422-0067), JCR IF = 4.556. Topics: Chemoinformatics, Bioinformatics, QSAR/QSPR Models, Molecular descriptors, Graph Theory, Complex Networks, Protein Interaction Networks, Metabolic Networks, Machine Learning, Artificial Neural Networks (ANN), Deep Learning, Software development, Guest Editor: Prof. Humberto González-Díaz, Email: mol2net.chair@gmail.com, Department of Organic and Inorganic Chemistry, and Basque Center for Biophysics, University of the Basque Country (UPV/EHU) and Ikerbasque - Basque Foundation for Science, 48011 Bilbao, Biscay, Spain. Submissions until: 30 April 2021.

25. IJMS (Call For Papers): Special Issue: Artificial Intelligence and Machine Learning in Drug Development. Journal: International Journal of Molecular Sciences IJMS (ISSN 1422-0067), JCR IF = 4.556. Topics: Artificial intelligence, Big data, In silico drug design and discovery, Biophysics, Omics, Clinical data, Near-real-time prediction algorithms; Personalized medicine, Guest Editor: Dr. Irina Moreira, Email: irina.moreira@cnc.uc.pt, 1. Coimbra University, Life Sciences Department, Coimbra, Portugal;
2. CNC - Center for Neuroscience and Cell Biology, University of Coimbra, Coimbra, Portugal. Submissions until: 31 Dec 2020.

24. Pharmaceutics (Call For Papers): Special Issue: Nanosystems as Drug Delivery Carrier: From Nature to the Medication. Journal: Pharmaceutics (ISSN 1999-4923), JCR IF = 4.421. Topics: drug delivery systems, cyclodextrin, nanomedicine, active drugs, bioavailability. Editor: Prof. Eduardo Sobarzo-Sanchez, Email: eduardo.sobarzo@ucentral.cl, Instituto de Investigación e Innovación en Salud, Facultad de Ciencias de la Salud, Universidad Central de Chile, Chile. Submissions until: 31 Oct 2020.

23. Nanomaterials (Call For Papers):Special Issue: Synthesis and Characterization of Nanostructured Templated Materials. Journal: Nanomaterials (ISSN 2079-4991), JCR IF = 4.324. Last Date: 2020-Nov-30, Editor: Prof. Juan M. Ruso, Department of Applied Physics, Faculty of Physics, University of Santiago de Compostela (USC), Santiago de Compostela, Spain.

22. Molecules (Call For Papers): Special Issue: Structure and Function of Metalloenzymes. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.267. Last Date: 2021-Jun-30. Topics: iminosugars, iminosugar synthesis, natural iminosugars, biological significance of iminosugars, pharmaceutical applications of iminosugars, pharmacological chaperones, sugar amino acids, isolation of iminosugars. Editors:Prof. Dr. Ramón J. Estévez Cabanas, Center for Research in Biological Chemistry and Molecular Materials, University of Santiago de Compostela, 15782 Santiago de Compostela, Spain. Prof. Dr. George Fleet, Chemistry Research Laboratory, Department of Chemistry, University of Oxford, Oxford, OX1 3TA, UK. Prof. Atsushi Kato, Department of Hospital Pharmacy, University of Toyama, 2630 Sugitani, Toyama 930-0194, Japan. Prof. Robert J. Nash, Phytoquest Limited, IBERS, Ceredigion, UK.

21. Molecules (Call For Papers):Special Issue: Structure and Function of Metalloenzymes. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.267. Last Date: 2020-Jun-30. Topics: catalytic power of enzymes; computer-aided drug design; bio-desulfurization; computational methods in chemistry and biochemistry; metalloenzymes; biological membranes; docking and virtual screening; computational enzymatic catalysis. Workshop Associated: EJIBCE, Encontro de Jovens Investigadores de Biologia Computacional e Estrutural, Portugal, 2018. Editor: Dr. Sérgio Filipe Sousa, Email: sergiofsousa@med.up.pt, UCIBIO/REQUIMTE, BioSIM - Departamento de BioMedicina, Faculdade de Medicina da Universidade do Porto, Porto, Portugal.

20. Molecules (Call For Papers): Special Issue: Cheminformatics, Past, Present, and Future: From Chemistry to Nanotechnology and Complex Systems. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.267. Last Date: 2020-Jul-31. Topics: Chemoinformatics, Multi-label classification, Quantum Mechanics, Molecular Mechanics (QM/MM), Molecular Docking, Big Data, Natural Computing, Quantum Computing, Artificial Neural Networks (ANN), Machine Learning, Data Analysis, Chemical Reactivity, Catalysis, Bioinformatics, Complex Biosystems, Protein Networks, Gene Regulatory Networks, Metabolic Networks, Computational Materials and Nano-sciences, Cheminformatics Regulatory issues, GDPR and Data Protection, OECD/REACH Regulation. Editors: Prof. Humbert González-Díaz, Current Affiliation: IKERBASQUE Professor, Dept. of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Basque Country, Spain. Email: mol2net.chair@gmail.com. Prof. Alejandro Pazos Sierra, Chair and Director of Department of Computer Science and Information Technology, University of Coruña (UDC), Coruña, Spain. Dr. Aliuska Duardo-Sanchez. Chair in Law & The Human Genome Research Group, PANELFIT H2020, Project Manager & EDC Board Coordinator, Europe Commission. Lecturer Criminal Law, Faculty of Law, University of The Basque Country UPV/EHU, Leioa (Great Bilbao), Biscay,Basque Country, Spain.

19. Molecules (Call For Papers): Special Issue: QSAR and QSPR: Recent Developments and Applications II. Journal: Molecules (ISSN 1420-3049), JCR IF = JCR IF = 3.267. Last Date: 2020-Dec-15. Section "Computational and Theoretical Chemistry". Editor: Prof. Alla Toropova, Current Affiliation: Laboratory of Environmental Chemistry and Toxicology, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy. Topics: QSPR/QSAR; Monte Carlo method; nanoinformatics; toxicology; nanotoxicology; drug discovery.

18. Entropy (Call for Papers): Special Issue: Statistical Inference from High Dimensional Data. Journal Entropy (ISSN 1099-4300), JCR IF = 2.4949. Editors: Prof. Carlos Fernández-Lozano. Department of Computer Science, Faculty of Computer Science, University of A Coruña, CITIC, A Coruña 15071, Spain. Date: 31 Dec 2020

17. Biology (Call For Papers): Special Issue: Computational Biology. Journal: Biology (ISSN 2079-7737) JCR IF = 3.796. Topics: computational biology, mathematical modeling, computational simulation, statistics, biochemistry, biophysics , molecular biology, computer science, anatomy, biomodeling, genomics, genetics, neuroscience, pharmacology, evolutionary biology. Editors: Dr. Milan Toma, Department of Osteopathic Manipulative Medicine, College of Osteopathic Medicine, New York Institute of Technology, Old Westbury Campus, Northern Boulevard, Old Westbury, NY 11568-8000, USA. Dr. RiccardoConcu, Requimte/Faculdade de Ciências da Universidade do Porto, Rua do Campo Alegre, s/n, 4169-007 Porto, Portugal. Submissions until: 30 Dec 2020.

Closed Journals Issues (Published)

16. Biomolecules (Call For Papers): Special Issue: Relevant Biomolecules for Germ Cells and Fertilization. Journal: Biomolecules (ISSN 2218-273X). JCR IF = 4.082. Topics: Germ cells, Gamete quality, Cryopreservation, Biomarkers, Antioxidants. Guest Editors: Prof. Vanessa Robles, Email: robles.vanesa@gmail.com, MODCELL Group, Department of Molecular Biology, Universidad de León, 24071 León, Spain. Dr. Marta F. Riesco, Spanish Institute of Oceanography (IEO), Santander, 39012, Spain, Dr. David G. Valcarce, Spanish Institute of Oceanography (IEO), Santander, 39012, Spain. Submissions until: 15 February 2020.

15. Biomolecules (Call For Papers): Special Issue: Big Data Analysis in Biomolecular Research, Bioinformatics, and Systems Biology with Complex Networks and Multi-Label Machine Learning Models. Journal: Biomolecules (ISSN 2218-273X). JCR IF = 4.082. Section: Bioinformatics and Systems Biology. Topics: Cheminformatics; Bioinformatics; Machine Learning; Complex Networks; Drug Discovery, Databases, Big Data, Systems Biology. Guest Editor: Prof. Humberto González-Díaz, Email: mol2net.chair@gmail.com, Department of Organic and Inorganic Chemistry, and Basque Center for Biophysics, University of the Basque Country (UPV/EHU) and Ikerbasque - Basque Foundation for Science, 48011 Bilbao, Biscay, Spain. Submissions until: 31 July 2020.

14. IJMS (Published): Special Issue: QSAR and Chemoinformatics Tools for Modeling. Journal: International Journal of Molecular Sciences IJMS (ISSN 1422-0067), JCR IF = 4.183. Topics: Chemometrics, QSAR/QSPR, Multi-criteria decision making, Molecular descriptors, Software development, Editor: Prof. Roberto Todeschini, Email: roberto.todeschini@unimib.it, University of Milano-Bicocca, Italy.

13. IJMS (Published): Special issue entitled: Molecular Recognition of Carbohydrates. Journal: International Journal of Molecular Sciences IJMS (ISSN 1422-0067), JCR IF = 3.257. Topics: Carbohydrates, Molecular recognition, NMR, Drug and Molecular probe design. Editors: Prof. Francisco Javier Cañada, Chemical and Physical Biology, Centro de Investigaciones Biológicas, CIB-CSIC, Ramiro de Maeztu 9, 28040 Madrid, Spain, Website 1 | Website 2 | E-Mail, Prof. Dr. Jesus Jimenez-Barbero, Website | E-Mail, (MOL2NET Honor Comm.), CIC bioGUNE, Bizkaia Technology Park, Building 800, 48160 Derio, Spain; Ikerbasque, Basque Foundation for Science, Maria López de Haro 3, 48013 Bilbao, Spain.

12. IJMS (Published): Special issue entitled: Data Analysis in Molecular Sciences. Journal: International Journal of Molecular Sciences IJMS (ISSN 1422-0067), JCR IF = 3.257. Topics: Cheminformatics, Computational Chemistry, Bioinformatics, Data Analysis, Proteomics, Biological Networks, Editors: Prof. Humbert González-Díaz, University of the Basque Country UPV/EHU, Biscay, Spain. Prof. Roberto Todeschini, University of Milano-Bicocca, Italy, Prof. Alejandro Pazos Sierra, University of Coruña UDC, Spain, Prof. Sonia Arrasate, University of the Basque Country (UPV/EHU), Biscay, Basque Country, Spain.

11. Nanomaterials (Published):Special Issue: Experimental Nanosciences, Computational Chemistry, and Data Analysis. Journal Nanomaterials (ISSN 2079-4991), JCR IF = 3.55. Editors: Prof. Humbert González-Díaz, UPV/EHU, Basque Country, Spain, Prof. Dr. H. Kušić, UZ, Croatia, Prof. B. Rasulev , NDSU, USA, Dr. Shameer Khader, Philips, Cambridge, MA, USA.

10. Nanomaterials (Call For Papers): Special Issue: From Nanoinformatics to Nanomaterials Risk Assessment and Governance. Journal: Nanomaterials (ISSN 2079-4991), JCR IF = 4.324. Last Date: 2020-Sept-01, Editors: Prof. Dario Greco, Faculty of Medicine and Health Technology, Tampere University, Tampere, Finland. Dr. Antreas Afantitis, Department of Cheminformatics, NovaMechanics Ltd, Nicosia, Cyprus. Prof. Iseult Lynch, School of Geography, Earth & Environmental Sciences, Univ. of Birmingham, United Kingdom. Dr. Maria Dusinska , Norwegian Institute for Air Research, NILU, Kjeller, Norway. Prof. Miguel A. Banares, Institute for Catalysis, CSIC, Madrid, Spain.

09. Molecules (Call For Papers): Special Issue: Recent Advances in Computational Drug Discovery: From In Silico Screening to Multiscale De Novo Drug Design. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.267. Last Date: 2020-Jan-31. Topics: Multi-Scale De Novo Drug Design, Multi-Scale Models, QSAR-Based Approaches, Chemoinformatics, Bioinformatics, Big Data and Data Mining, Computer-Aided Drug Discovery, and Virtual Screening. Editor: Prof. Alejandro Speck-Planche, Email: alejspivanovich@gmail.com, Department of Chemistry (Institute of Pharmacy), I.M. Sechenov First Moscow State Medical University, Moscow, Russian Federation.

08. Molecules (Call For Papers): Special Issue: Natural Products for Neurodegenerative Diseases. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.267. Last Date: 2020-Apr-30. Topics: Medicinal chemistry; Natural products; Photochemistry reactivity; Aporphines, oxoaporphines, and oxoisoaporphines; Coumarins. Editor: Prof. Eduardo Sobarzo-Sanchez, Email: eduardo.sobarzo@ucentral.cl, Instituto de Investigación e Innovación en Salud, Facultad de Ciencias de la Salud, Universidad Central de Chile, Chile.

07. Molecules (Call For Papers): Special Issue: Computational Methods for Drug Discovery and Design. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.098. Last Date: 2019-Dec-30. Topics: molecular modeling; molecular simulations; computational biochemistry; computer-aided drug design; protein kinase inhibitors. Editor: Prof. Julio Caballero, Email: jcaballero@utalca.cl, Centro de Bioinformática y Simulación Molecular (CBSM), Facultad de Ingeniería, Universidad de Talca, Casilla 747, Talca 3460000, Chile.

06. Molecules (Published): Special Issue: GPCR Mechanism and Drug Design. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.06. Last Date: 2019-Nov-30. Topics: data science; drug design and discovery; computational chemistry; structural biology; molecular modeling; molecular docking; computational mutagenesis; G-protein-coupled receptors; protein–protein interactions; protein–ligand interactions. Workshop Associated: EJIBCE, Encontro de Jovens Investigadores de Biologia Computacional e Estrutural, Portugal, 2018. Editor: Dr. Irina Moreira, Email: irina.moreira@cnc.uc.pt, Center for Neuroscience and Cell Biology (CNC), University of Coimbra (UC), Portugal.

05. Molecules (Published): Special Issue: From Computational Chemistry to Complex Networks. Journal: Molecules (ISSN 1420-3049), JCR IF = 3.06. Topics: Quantum Mechanics /Molecular Mechanics (QM/MM), Drug-target, protein-protein and other Docking methods, Monte Carlo (MC) methods, Quantitative Structure-Activity/Property Relationships (QSAR/QSPR) models, Graph theory and Complex Networks Topological Indices (TIs), Protein Structure Networks, Protein Interaction Networks (PINs) and Proteome. Editor: Prof. Humbert González-Díaz, Email: mol2net.chair@gmail.com, Current Affiliation: IKERBASQUE Professor, Dept. of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Basque Country, Spain.

04. Entropy (Published): Special Issue: Graph and Network Entropies. Journal Entropy (ISSN 1099-4300), JCR IF = 2.419. Topics: network sciences; walk entropies; algegraic graph theory; spectral methods; matrix functions. Editor: Prof. Ernesto Estrada, Email: ernesto.estrada@strath.ac.uk, Department of Mathematics & Statistics, University of Strathclyde, Glasgow G11XQ, United Kingdom. Current Affiliation: ARAID Professor, Institute of Applied Mathematics (IUMA), University of Zaragoza, Spain.

03. Entropy (Call for Papers): Special Issue: Biological Statistical Mechanics. Journal Entropy (ISSN 1099-4300), JCR IF = 2.494. Last Date: 2019-Nov-15. Topics: cell differentiation, biocomplexity, order and organization, ecology, epidemics, correlation dynamics, complex networks, systems biology. Editors: Prof. Alessandro Giuliani, Email: alessandro.giuliani@iss.it, Environment and Health Department, Istituto Superiore di Sanità, Roma 00161, Italy. Prof. Mariano Bizzarri, Department of Experimental Medicine, Systems Biology Group Lab, Sapienza University of Rome, Rome, Italy.

02. Applied Sciences (Published): Special issue entitled: Applied Artificial Neural Networks. Journal Applied Sciences (ISSN 2076-3417), JCR IF = 2.217. Topics: Evolutionary Computation; Artificial Neural Networks; Artificial Intelligence; Feature Selection; Machine Learning. Editor: Prof. Marcos Gestal. Email: marcos.gestal@udc.es, Computation Sciences and Information Technologies Department, Faculty of Computer Science, University of A Coruña, 15071, A Coruña, Spain.

01. Applied Sciences (Published): Special issue entitled: Complex Networks and Machine Learning: From Molecular to Social Sciences. Journal Applied Sciences (ISSN 2076-3417), JCR IF = 2.217. Topics: machine learning, complex networks, systems biology, protein networks, metabolic networks, ecosystems, artificial neural networks, social, financial, and legal networks. Editors: Prof. Maykel Cruz-Monteagudo, Email: mCruz@westcoastuniversity.edu, West Coast University, Miami Campus, FL, USA, Prof. David Quesada, Director of Dept. of Mathematics, Miami Dade Colege (MDC), Miami, FL, USA. Email: dquesada@mdc.edu, Prof. Humbert González-Díaz, Email: mol2net.chair@gmail.com, IKERBASQUE Professor, Dept. of Organic Chemistry II, University of the Basque Country UPV/EHU , 48940, Leioa, Biscay, Basque Country, Spain.

MOL2NET-MDPI Journals (Selected Papers)

Concise Polygenic Models for Cancer-Specific Identification of Drug-Sensitive Tumors from Their Multi-Omics Profiles
by Stefan Naulaerts , Michael P. Menden and Pedro J. Ballester
Biomolecules 2020, 10(6), 963; https://doi.org/10.3390/biom10060963

Exploring Alzheimer’s Disease Molecular Variability via Calculation of Personalized Transcriptional Signatures
by Hila Dagan, Efrat Flashner-Abramson, Swetha Vasudevan, Maria R. Jubran, Ehud CohenandNataly Kravchenko-Balasha
Biomolecules 2020, 10(4), 503; https://doi.org/10.3390/biom10040503

Topical Delivery of Meloxicam using Liposome and Microemulsion Formulation Approaches
by Julia Zhang , Anna Froelich and Bozena Michniak-Kohn
Pharmaceutics 2020, 12(3), 282; https://doi.org/10.3390/pharmaceutics12030282

Soft Actuated Hybrid Hydrogel with Bioinspired Complexity to Control Mechanical Flexure Behavior for Tissue Engineering
by Ramón Rial , Zhen Liu and Juan M. Ruso
Nanomaterials 2020, 10(7), 1302; https://doi.org/10.3390/nano10071302

Data Analysis in Chemistry and Bio-Medical Sciences

by Roberto Todeschini ,Alejandro Pazos ,Sonia Arrasate and Humberto González-Díaz

Int. J. Mol. Sci. 2016, 17(12), 2105; https://doi.org/10.3390/ijms17122105

Complex Networks and Machine Learning: From Molecular to Social Sciences

by David Quesada , Maykel Cruz-Monteagudo ,Terace Fletcher ,Aliuska Duardo-Sanchez and Humbert González-Díaz

Appl. Sci. 2019, 9(21), 4493; https://doi.org/10.3390/app9214493

Modeling of Interactions between the Zebrafish Hatching Enzyme ZHE1 and A Series of Metal Oxide Nanoparticles: Nano-QSAR and Causal Analysis of Inactivation Mechanisms. by Natalia Sizochenko ,Danuta Leszczynska andJerzy Leszczynski

Nanomaterials 2017, 7(10), 330; https://doi.org/10.3390/nano7100330

Data Analysis in Chemistry and Bio-Medical Sciences

by Roberto Todeschini , Alejandro Pazos ,Sonia Arrasate andHumberto González-Díaz

Int. J. Mol. Sci. 2016, 17(12), 2105; https://doi.org/10.3390/ijms17122105

Interactions between a Heparin Trisaccharide Library and FGF-1 Analyzed by NMR Methods

by María José García-Jiménez ,Sergio Gil-Caballero , Ángeles Canales ,Jesús Jiménez-Barbero ,José L. De Paz andPedro M. Nieto

Int. J. Mol. Sci. 2017, 18(6), 1293; https://doi.org/10.3390/ijms18061293

Development of Multi-Target Chemometric Models for the Inhibition of Class I PI3K Enzyme Isoforms: A Case Study Using QSAR-Co Tool. by Amit Kumar Halder and M. Natália Dias Soeiro Cordeiro.
Int. J. Mol. Sci. 2019, 20(17), 4191; https://doi.org/10.3390/ijms20174191

Improvement of Epitope Prediction Using Peptide Sequence Descriptors and Machine Learning. by Cristian R. Munteanu ,Marcos Gestal ,Yunuen G. Martínez-Acevedo ,Nieves Pedreira , Alejandro Pazos and Julián Dorado.
Int. J. Mol. Sci. 2019, 20(18), 4362; https://doi.org/10.3390/ijms20184362

Alignment-Free Method to Predict Enzyme Classes and Subclasses. by Riccardo Concu and M. Natália D. S. Cordeiro.
Int. J. Mol. Sci. 2019, 20(21), 5389; https://doi.org/10.3390/ijms20215389

Artificial Neural Network (ANN) as a Tool to Reduce Human-Animal Interaction Improves Senegalese Sole Production. by Juan M. Martínez-Vázquez ,David G. Valcarce ,Marta F. Riesco ,Vicent Sanz Marco ,Morito Matsuoka and Vanesa Robles.
Biomolecules 2019, 9(12), 778; https://doi.org/10.3390/biom9120778

Dynamical Rearrangement of Human Epidermal Growth Factor Receptor 2 upon Antibody Binding: Effects on the Dimerization. by Pedro R. Magalhães , Miguel Machuqueiro , José G. Almeida ,André Melo , M. Natália D. S. Cordeiro ,Sandra Cabo Verde ,Zeynep H. Gümüş , Irina S. Moreira , João D. G. Correia and Rita Melo. Biomolecules 2019, 9(11), 706; https://doi.org/10.3390/biom9110706

A Computational Toxicology Approach to Screen the Hepatotoxic Ingredients in Traditional Chinese Medicines: Polygonum multiflorum Thunb as a Case Study, by Shuaibing He , Xuelian Zhang ,Shan Lu , Ting Zhu , Guibo Sun and Xiaobo Sun

Biomolecules 2019, 9(10), 577; https://doi.org/10.3390/biom9100577

Comparative Analysis of MicroRNA and mRNA Profiles of Sperm with Different Freeze Tolerance Capacities in Boar (Sus scrofa) and Giant Panda (Ailuropoda melanoleuca). by Ming-Xia Ran ,Ying-Min Zhou ,Kai Liang ,Wen-Can Wang ,Yan Zhang ,Ming Zhang ,Jian-Dong Yang ,Guang-Bin Zhou ,Kai Wu ,Cheng-Dong Wang ,Yan Huang ,Bo Luo ,Izhar Hyder Qazi ,He-Min Zhang andChang-Jun Zeng

Biomolecules 2019, 9(9), 432; https://doi.org/10.3390/biom9090432

Long Exposure to a Diet Supplemented with Antioxidant and Anti-Inflammatory Probiotics Improves Sperm Quality and Progeny Survival in the Zebrafish Model. by David G. Valcarce ,Marta F. Riesco ,Juan M. Martínez-Vázquez and Vanesa Robles

Biomolecules 2019, 9(8), 338; https://doi.org/10.3390/biom9080338

Embryonic Exposure to Bisphenol A Impairs Primordial Germ Cell Migration without Jeopardizing Male Breeding Capacity. by Marta Lombó , Lidia Getino-Álvarez ,Alexandra Depincé ,Catherine Labbé and María Paz Herráez

Biomolecules 2019, 9(8), 307; https://doi.org/10.3390/biom9080307

Delivery of Iron Oxide Nanoparticles into Primordial Germ Cells in Sturgeon. by Abdul Rasheed Baloch ,Michaela Fučíková ,Marek Rodina ,Brian Metscher ,Tomáš Tichopád ,Mujahid Ali Shah ,Roman Franěk andMartin Pšenička. Biomolecules 2019, 9(8), 333; https://doi.org/10.3390/biom9080333

Regular Equivalence for Social Networks

by Pieter Audenaert ,Didier Colle and Mario Pickavet

Appl. Sci. 2019, 9(1), 117; https://doi.org/10.3390/app9010117

Network Entropy for the Sequence Analysis of Functional Connectivity Graphs of the Brain

by Chi Zhang ,Fengyu Cong ,Tuomo Kujala ,Wenya Liu ,Jia Liu ,Tiina Parviainen andTapani Ristaniemi

Entropy 2018, 20(5), 311; https://doi.org/10.3390/e20050311 -