Search Result "topological descriptors"


Detour Cum Distance Matrix Based Topological Descriptors for QSAR/QSPR Part-I: Development and Evaluation

Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 7 Year: 2014 Page: 844-863
Author(s): Monika Gupta, Harish Jangra, Prasad V. Bharatam, Anil K. Madan

Detour Cum Distance Matrix Based Topological Descriptors for QSAR/QSPR Part-II: Application in Drug Discovery Process

Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 7 Year: 2014 Page: 864-876
Author(s): Monika Gupta, Anil K. Madan

Virtual Screening and Molecular Descriptor Analysis on Dietary Phytochemicals Against Heat Shock Protein 90 Enzyme

Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 1 Year: 2014 Page: 40-49
Author(s): Salam Pradeep Singh,Bolin Kumar Konwar

A Review on Principles, Theory and Practices of 2D-QSAR

Journal: Current Drug Metabolism
Volume: 15 Issue: 4 Year: 2014 Page: 346-379
Author(s): Kunal Roy,Rudra Narayan Das

A Survey of Molecular Descriptors Used in Mass Spectrometry Based Proteomics

Journal: Current Topics in Medicinal Chemistry
Volume: 14 Issue: 3 Year: 2014 Page: 388-397
Author(s):

Classification of Aurora B Kinase Inhibitors Using Computational Models

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 17 Issue: 2 Year: 2014 Page: 114-123
Author(s): Ruizi Liu,Xianglei Nie,Min Zhong,Xiaoli Hou,Shouyi Xuan,Aixia Yan

A Combined Cheminformatics and Computational Approach for the Prediction of Anti-HIV Small Molecules

Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 4 Year: 2014 Page: 349-353
Author(s): Naghmeh Poorinmohammad,Hassan Mohabatkar

QSAR Models for Anti-Malarial Activity of 4-Aminoquinolines

Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 1 Year: 2014 Page: 75-82
Author(s): Vijay H. Masand,Andrey A. Toropov,Alla P. Toropova,Devidas T. Mahajan

Lacosamide Derivatives with Anticonvulsant Activity as Carbonic Anhydrase Inhibitors. Molecular Modeling, Docking and QSAR Analysis

Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 2 Year: 2014 Page: 160-167
Author(s): Juan C. Garro Martinez,Esteban G. Vega-Hissi,Matias F. Andrada,Pablo R. Duchowicz,Francisco Torrens,Mario R. Estrada

Galvez-Markov Network Transferability Indices: Review of Classic Theory and New Model for Perturbations in Metabolic Reactions

Journal: Current Drug Metabolism
Volume: 15 Issue: 5 Year: 2014 Page: 557-564
Author(s): Jorge Vergara-Galicia,Francisco J. Prado-Prado,Humberto Gonzalez-Diaz

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