Search Result "topostructural indices"
Quantitative Structure-Activity Relationships for Anticancer Activity of 2- Phenylindoles Using Mathematical Molecular Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 98-108
Author(s): Subhash C. Basak, Qianhong Zhu, Denise Mills
Shannonâs, 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
A QSAR Study of HIV Protease Inhibitors Using Theoretical Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 269-282
Author(s): Subhash C. Basak, Denise Mills, Rajni Garg, Barun Bhhatarai
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
Adapting Interrelated Two-Way Clustering Method for Quantitative Structure-Activity Relationship (QSAR) Modeling of Mutagenicity/Non- Mutagenicity of a Diverse Set of Chemicals
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 463-471
Author(s): Subhabrata Majumdar,Subhash C. Basak,Gregory D. Grunwald
Graph Theory Concepts in the Rationales of Anti HIV-1 Compounds
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 472-481
Author(s): Utsab Debnath,Seturam B. Katti,Yenamandra S. Prabhakar
Use of Mathematical Structural Invariants in Analyzing Combinatorial Libraries: A Case Study with Psoralen Derivatives
Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 240-251
Author(s): Subhash C. Basak, Denise Mills, Brian D. Gute, Alexandru T. Balaban, Kanika Basak, Gregory D. Grunwald
Mathematical Descriptors for the Prediction of Property, Bioactivity, and Toxicity of Chemicals from their Structure: A Chemical-Cum-Biochemical Approach
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 449-462
Author(s): Subhash C. Basak
Development of Structure Information from Molecular Topology for Modeling Chemical and Biological Properties: A Tribute to the Creativity of Lemont Burwell Kier on his 80th Birthday
Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 2 Year: 2012 Page: 93-106
Author(s): Lowell H. Hall
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