Search Result "Molconn-X topological descriptors"
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
Identification of the Descriptor Pharmacophores Using Variable Selection QSAR Applications to Database Mining
Journal: Current Pharmaceutical Design
Volume: 7 Issue: 7 Year: 2001 Page: 599-612
Author(s): Alexander Tropsha, Zheng Weifan
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
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
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
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
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
Obtaining Microbiological and Pharmacokinetic Highly Predictive Equations
Journal: Current Topics in Medicinal Chemistry
Volume: 18 Issue: 11 Year: 2018 Page: 908-916
Author(s): Jose I. Bueso-Bordils,Pedro A. Aleman-López,Sara Costa-Piles,Maria J. Duart,Luis Lahuerta-Zamora,Rafael Martin-Algarra,Gerardo M. Anton-Fos
ISIDA - Platform for Virtual Screening Based on Fragment and Pharmacophoric Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 3 Year: 2008 Page: 191-198
Author(s): Alexandre Varnek, Denis Fourches, Dragos Horvath, Olga Klimchuk, Cedric Gaudin, Philippe Vayer, Vitaly Solovev, Frank Hoonakker, Igor V. Tetko, Gilles Marcou
The Present Utility and Future Potential for Medicinal Chemistry of QSAR / QSPR with Whole Molecule Descriptors
Journal: Current Topics in Medicinal Chemistry
Volume: 2 Issue: 1 Year: 2002 Page: 1333-1356
Author(s): Alan R. Katritzky, Dan C. Fara, Ruslan O. Petrukhin, Douglas B. Tatham, Uko Maran, Andre Lomaka, Mati Karelson