Search Result "topological descriptors"


Research Article

Application of Topological Descriptors in QSAR Modeling: Substituted Hydrazones Used As a Model System

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 3 Year: 2020 Page: 253-263
Author(s): Vesna Dimova,Mirjana S. Jankulovska

QSAR Modeling of Carcinogenic Risk Using Discriminant Analysis and Topological Molecular Descriptors

Journal: Current Drug Discovery Technologies
Volume: 2 Issue: 2 Year: 2005 Page: 55-67
Author(s): Joseph F. Contrera, Philip MacLaughlin, Lowell H. Hall, Lemont B. Kier

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

Application of Topological Descriptors in QSAR and Drug Design: History and New Trends

Journal: Current Drug Targets - Infectious Disorders
Volume: 2 Issue: 1 Year: 2002 Page: 93-102
Author(s): R. Gozalbes, J. P. Doucet, F. Derouin

Topological Descriptors in Modeling the HIV Inhibitory Activity of 2-Aryl-3- pyridyl-thiazolidin-4-ones

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 8 Issue: 5 Year: 2005 Page: 431-437
Author(s): Y. S. Prabhakar, R. K. Rawal, M. K. Gupta, V. Raja Solomon, S. B. Katti

An Integrated Drug Development Approach Applying Topological Descriptors

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 3 Year: 2012 Page: 172-181
Author(s): Alan Talevi, Carolina L. Bellera, Mauricio Di Ianni, Pablo R. Duchowicz, Luis E. Bruno-Blanch, Eduardo A. Castro

Predicting Dopamine Receptors Binding Affinity of N-[4-(4-Arylpiperazin- 1-yl) butyl]Aryl Carboxamides: Computational Approach Using Topological Descriptors

Journal: Current Drug Discovery Technologies
Volume: 2 Issue: 2 Year: 2005 Page: 115-121
Author(s): Viney Lather, A. K. Madan

Chemistry Explained by Topology: An Alternative Approach

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 4 Year: 2011 Page: 279-283
Author(s):

Topological Polar Surface Area: A Useful Descriptor in 2D-QSAR

Journal: Current Medicinal Chemistry
Volume: 16 Issue: 1 Year: 2009 Page: 21-41
Author(s): S. Prasanna, R. J. Doerksen

How Can We Explain the Stability of Conjugated Hydrocarbon- and Heterosubstituted Networks by Topological Descriptors?

Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 225-234
Author(s): Haruo Hosoya

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