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Perturbation Theory/Machine Learning Model of ChEMBL Data for Dopamine Targets: Docking, Synthesis, and Assay of New l-Prolyl-l-leucyl-glycinamide Peptidomimetics
Joana Ferreira Da Costa, 1 David Silva, 1 Olga Caamaño, 1 José M. Brea, 2 María Isabel Loza, 2 Cristian R. Munteanu, 3 Alejandro Pazos, 3 Xerardo García-Mera, 1 Humbert Gonzalez-Diaz 4
1  Department of Organic Chemistry, University of Santiago de Compostela, 15782 Santiago de Compostela, Spain
2  CIMUS, University of Santiago de Compostela, 15782 Santiago de Compostela, Spain
3  Instituto de Investigacion Biomedica de A Coruña (INIBIC), Complexo Hospitalario Universitario de A Coruña (CHUAC), A Coruña, 15006, Spain
4  Department of Organic Chemistry II, University of Basque Country UPV/EHU, 48940 Leioa, Spain

Published: 23 May 2018 by American Chemical Society (ACS) in ACS Chemical Neuroscience
American Chemical Society (ACS), Volume 9; 10.1021/acschemneuro.8b00083
Keywords: model, molecular docking, Chembl, PLG, Targeting Dopamine, Assay of New, Dopamine pathway proteins, assays of compounds
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