Search Result "Topological molecular descriptor."


Discrimination of Small Molecules Using Topological Molecular Descriptors

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 2 Year: 2015
Author(s): Chandan Raychaudhury,Debnath Pal
Doi: 10.2174/9781681080529115020007

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

Basic Concepts and Applications of Molecular Topology to Drug Design

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 1 Year: 2014
Author(s): Jorge Gálvez,María Gálvez-Llompart,Ramón García-Domenech
Doi: 10.2174/9781608059287114010012

Molecular Design and QSARs/QSPRs with Molecular Descriptors Family

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 195-205
Author(s): Sorana D. Bolboaca,Lorentz Jantschi,Mircea V. Diudea

Chemistry Explained by Topology: An Alternative Approach

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

Introduction to Molecular Topology: Basic Concepts and Application to Drug Design

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 3 Year: 2012 Page: 196-223
Author(s): Jorge Galvez,Maria Galvez-Llompart,Ramon Garcia-Domenech

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

On the Contribution of Molecular Topology to Drug Design and Discovery

Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 252-268
Author(s): Jorge Galvez, Ramon Garcia-Domenech

Basic Concepts and Applications of Molecular Topology to Drug Design

Ebook: Advances in Mathematical Chemistry and Applications Volume 1 (Revised Edition)
Volume: 1 Year: 2015
Author(s): Jorge Gálvez,María Gálvez-Llompart,Ramón García-Domenech
Doi: 10.2174/9781681081977115010012

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