Search Result "electrotopological indices"

Electrotopological State Atom (E-State) Index in Drug Design, QSAR, Property Prediction and Toxicity Assessment

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 2 Year: 2012 Page: 135-158
Author(s): Kunal Roy,Indrani Mitra

Exploring QSAR of Flavonoids as Scavengers of Peroxynitrite Using Electrotopological State (E-State) Atom Parameter

Journal: Letters in Drug Design & Discovery
Volume: 7 Issue: 8 Year: 2010 Page: 618-624
Author(s): Supratim Ray

Structural, Chemical Topological, Electrotopological and Electronic Structure Hypotheses

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 6 Issue: 8 Year: 2003 Page: 801-809
Author(s): F. Torrens

Review Article

Physicochemical Significance of Topological Indices: Importance in DrugDiscovery Research

Journal: Current Topics in Medicinal Chemistry
Volume: 23 Issue: 29 Year: 2023 Page: 2735-2742
Author(s): Anil Kumar Saxena,Karanpreet Singh Bhatia,Ankit Kumar Gupta

Shannon’s, Mutual, Conditional and Joint Entropy Information Indices: Generalization of Global Indices Defined from Local Vertex Invariants

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 164-183
Author(s): Stephen J. Barigye,Yovani Marrero-Ponce,Oscar Martinez Santiago,Yoan Martinez Lopez,Facundo Perez-Gimenez,Francisco Torrens

QSAR: Then and Now

Journal: Current Topics in Medicinal Chemistry
Volume: 2 Issue: 1 Year: 2002 Page: 1357-1379
Author(s): C. D. Selassie, S. B. Mekapati, R. P. Verma

Importance of Kier-Hall Topological Indices in the QSAR of Anticancer Drug Design

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 2 Year: 2012 Page: 159-170
Author(s): Sisir Nandi,Manish C. Bagchi

Computational Approaches to Improve Aggrecanase-1 Inhibitory Activity of (4-keto) Phenoxy) Methyl Biphenyl-4-sulfonamide: Group Based QSAR and Docking Studies

Journal: Medicinal Chemistry
Volume: 8 Issue: 4 Year: 2012 Page: 673-682
Author(s): Ponnurengam Malliappan Sivakumar,Naga Vignesh Selvaraj,G. Ramesh,J. Mohanapriya,Veluchamy Prabhawathi,Mukesh Doble

Modeling of Programmed-Temperature Retention Indices of a Diverse Set of Natural Compounds by Subspace Orthogonal Projection

Journal: Current Analytical Chemistry
Volume: 8 Issue: 1 Year: 2012 Page: 168-179
Author(s): Chenxi Zhao, Yizeng Liang, Xiaomei Wang, Linqi Liu, Dalin Yuan, Tianquan Wu, Qingsong Xu

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