Search Result "Topological quantum similarity indices"


Review Article

Discriminating Drug-Like Compounds by Partition Trees with Quantum Similarity Indices and Graph Invariants

Journal: Current Pharmaceutical Design
Volume: 22 Issue: 34 Year: 2016 Page: 5179-5195
Author(s): Jesus V. de Julián-Ortiz,Rafael Gozalbes,Emili Besalú

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

Chemistry Explained by Topology: An Alternative Approach

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

Research Article

Comparative Study of Valency-Based Topological Indices for Tetrahedral Sheets of Clay Minerals

Journal: Current Organic Synthesis
Volume: 18 Issue: 7 Year: 2021 Page: 711-718
Author(s): Hassan Raza,Muhammad Faisal Nadeem,Ali Ahmad,Muhammad Ahsan Asim,Muhammad Azeem

Molecular Similarity and Property Similarity

Journal: Current Topics in Medicinal Chemistry
Volume: 4 Issue: 6 Year: 2004 Page: 589-600
Author(s): Frederique Barbosa, Dragos Horvath

Medicinal Chemistry and Bioinformatics - Current Trends in Drugs Discovery with Networks Topological Indices

Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2007 Page: 1015-1029
Author(s): Humberto Gonzalez-Diaz, Santiago Vilar, Lourdes Santana, Eugenio Uriarte

Quantum Pharmacology for Infectious Diseases: A Molecular Connectivity Approach

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 3 Year: 2012 Page: 249-254
Author(s): Shailza Singh

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

Predicting Drugs and Proteins in Parasite Infections with Topological Indices of Complex Networks: Theoretical Backgrounds, Applications and Legal Issues

Journal: Current Pharmaceutical Design
Volume: 16 Issue: 2 Year: 2010 Page: 2737-2764
Author(s): Humberto Gonzalez-Diaz, Fernanda Romaris, Aliuska Duardo-Sanchez, Lazaro G. Perez-Montoto, Francisco Prado-Prado, Grace Patlewicz, Florencio M. Ubeira

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

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