Search Result "descriptor set"
Selection, Application, and Validation of a Set of Molecular Descriptors for Nuclear Receptor Ligands
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 7 Issue: 5 Year: 2004 Page: 407-412
Author(s): Eugene L. Stewart, Peter J. Brown, James A. Bentley, Timothy M. Willson
A Random Forest Model to Predict the Activity of a Large Set of Soluble Epoxide Hydrolase Inhibitors Solely Based on a Set of Simple Fragmental Descriptors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 22 Issue: 8 Year: 2019 Page: 555-569
Author(s): Jamal Shamsara
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
OCWLGI Descriptors: Theory and Praxis
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 226-232
Author(s): Andrey A. Toropov,Alla P. Toropova,Emilio Benfenati,Giuseppina Gini
Comparison of Methods for Sequential Screening of Large Compound Sets
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 9 Issue: 2 Year: 2006 Page: 115-122
Author(s): Paul E. Blower, Kevin P. Cross, Gabriel S. Eichler, Glenn J. Myatt, John N. Weinstein, Chihae Yang
QSAR Study for Carcinogenicity in a Large Set of Organic Compounds
Journal: Current Drug Safety
Volume: 7 Issue: 4 Year: 2012 Page: 282-288
Author(s): Pablo R. Duchowicz,Nieves C. Comelli,Erlinda V. Ortiz,Eduardo A. Castro
Development of Quantitative Structure-Activity Relationship for a Set of Carbonic Anhydrase Inhibitors: Use of Quantum and Chemical Descriptors
Journal: Letters in Drug Design & Discovery
Volume: 3 Issue: 9 Year: 2006 Page: 622-635
Author(s): Padmakar V. Khadikar, Omar Deeb, Amal Jaber, Jyoti Singh, Vijay K. Agrawal, Shalini Singh, Meenakshi Lakhwani
Intercorrelation of Major DNA/RNA Sequence Descriptors - A Preliminary Study
Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 3 Year: 2016 Page: 216-228
Author(s): Dwaipayan Sen,Subhadeep Dasgupta,Indrajit Pal,Smarajit Manna,Subhash C. Basak,Ashesh Nandy,Gregory D. Grunwald
Building a Chemical Space Based on Fragment Descriptors
Ebook: Advances in Combinatorial Chemistry & High Throughput Screening
Volume: 1 Year: 2013
Author(s): Igor I. Baskin,Alexandre Varnek
Doi: 10.2174/9781608057450113010005
Building a Chemical Space Based on Fragment Descriptors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 11 Issue: 8 Year: 2008 Page: 661-668
Author(s): Igor Baskin, Alexandre Varnek