Search Result "Theoretical descriptors"
QSAR of Chalcones Utilizing Theoretical Molecular Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 11 Issue: 2 Year: 2015 Page: 184-193
Author(s): Sisir Nandi,Manish C. Bagchi
Estimation of Human Carbonic Anhydrase II Inhibition Using Topological Indices and their Combination with Quantum-Theoretical Descriptors
Journal: Medicinal Chemistry
Volume: 4 Issue: 1 Year: 2008 Page: 30-66
Author(s): Padmakar V. Khadikar, Jyoti Singh, Shalini Singh, Rajika Mishra, Claudiu T. Supuran, Brian W. Clare, Meenakshi Lakhwani
A QSAR Study of HIV Protease Inhibitors Using Theoretical Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 269-282
Author(s): Subhash C. Basak, Denise Mills, Rajni Garg, Barun Bhhatarai
Evaluation of the Protonation Energy of Molecules using Conceptual Density Functional Theoretical Reactivity Descriptors
Journal: Current Physical Chemistry
Volume: 7 Issue: 2 Year: 2017 Page: 126-132
Author(s): Sandip K. Rajak,Nazmul Islam,Dulal C. Ghosh
Inductive Descriptors: 10 Successful Years in QSAR
Journal: Current Computer-Aided Drug Design
Volume: 1 Issue: 1 Year: 2005 Page: 21-42
Author(s): A. Cherkasov
Building a Chemical Space Based on Fragment Descriptors
Ebook: Advances in Combinatorial Chemistry & High Throughput Screening
Volume: 1 Year: 2013
Author(s): Igor I. Baskin,Alexandre Varnek
Doi: 10.2174/9781608057450113010005
Building a Chemical Space Based on Fragment Descriptors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 11 Issue: 8 Year: 2008 Page: 661-668
Author(s): Igor Baskin, Alexandre Varnek
A Short Review of the Generation of Molecular Descriptors and Their Applications in Quantitative Structure Property/Activity Relationships
Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 3 Year: 2016 Page: 181-205
Author(s): Sagarika Sahoo,Chandana Adhikari,Minati Kuanar,Bijay K. Mishra
Theoretical Evaluation and Classifications of Potential Antimalarial Phenazine Compounds
Journal: Letters in Organic Chemistry
Volume: 8 Issue: 1 Year: 2011 Page: 752-762
Author(s): Tania M.B. e Silva, Nely T.V. Cerqueira, Sheyla W.D. Silva, Felipe de M. Santos, Terezinha F. Oliveira, Roberta L. Ziolli, Carlton A. Taft
Multivariate QSAR: From Classical Descriptors to New Perspectives
Journal: Current Computer-Aided Drug Design
Volume: 3 Issue: 4 Year: 2007 Page: 235-239
Author(s): Matheus P. Freitas