Search Result "DUD"
Enhancing Scoring Performance of Docking-Based Virtual Screening Through Machine Learning
Journal: Current Bioinformatics
Volume: 11 Issue: 4 Year: 2016 Page: 408-420
Author(s): Cândida G. Silva,Carlos J.V. Simoes,Pedro Carreiras,Rui M.M. Brito
Learning the Edit Costs of Graph Edit Distance Applied to Ligand-Based Virtual Screening
Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 18 Year: 2020 Page: 1582-1592
Author(s): Carlos Garcia-Hernandez,Alberto Fernández,Francesc Serratosa
Integrated Application of Enhanced Replacement Method and Ensemble Learning for the Prediction of BCRP/ABCG2 Substrates
Journal: Current Bioinformatics
Volume: 12 Issue: 3 Year: 2017 Page: 239-248
Author(s): Melisa E. Gantner,Lucas N. Alberca,Andrew G. Mercader,Luis E. Bruno-Blanch,Alan Talevia
Fusing Docking Scoring Functions Improves the Virtual Screening Performance for Discovering Parkinson's Disease Dual Target Ligands
Journal: Current Neuropharmacology
Volume: 15 Issue: 8 Year: 2017 Page: 1107-1116
Author(s): Yunierkis Perez-Castillo,Aliuska Morales Helguera,M.Natalia D. S. Cordeiro,Eduardo Tejera,Cesar Paz-y-Mino,Aminael Sanchez-Rodriguez,Fernanda Borges,Maykel Cruz-Monteagudo
Approaches to Virtual Screening and Screening Library Selection
Journal: Current Pharmaceutical Design
Volume: 19 Issue: 26 Year: 2013 Page: 4787-4796
Author(s): Scott A. Wildman
The Natural Protoalkaloid Methyl-2-Amino-3-Methoxybenzoate (MAM)Alleviates Positive as well as Cognitive Symptoms in Rat and MouseSchizophrenia Models
Journal: Current Neuropharmacology
Volume: 22 Issue: 2 Year: 2024 Page: 323-338
Author(s): Dorien A. Maas,Michel M.M. Verheij,Maria S. Paladini,Helene I.V. Amatdjais-Groenen,Marco A. Riva,Gerard J.M. Martens,Judith R. Homberg
Improvement of Virtual Screening Predictions using Computational Intelligence Methods
Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 1 Year: 2014 Page: 33-39
Author(s): Gaspar Cano,José GarcÃa-RodrÃguez,Horacio Pérez-Sánchez
Prediction of Bioactive Compounds Using Computed NMR Chemical Shifts
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 6 Year: 2015 Page: 562-576
Author(s): Muthukumarasamy Karthikeyan,Pattuparambil Ramanpillai Rajamohanan,Renu Vyas
Processing of Small Molecule Databases for Automated Docking
Journal: Medicinal Chemistry
Volume: 3 Issue: 1 Year: 2007 Page: 107-113
Author(s): Maxwell D. Cummings, Alan C. Maxwell, Renee L. DesJarlais
Focus in Organic Chemistry ( Catalytic Asymmetric Alkynylation of -Imino Ester: A Versatile Approach to Optically Active Unnatural -Amino Acid Derivatives )
Journal: Letters in Organic Chemistry
Volume: 3 Issue: 5 Year: 2006 Page: 328-330
Author(s):