Search Result "Molecular image descriptor"

Review Article

A Short Review of the Generation of Molecular Descriptors and Their Applications in Quantitative Structure Property/Activity Relationships

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 3 Year: 2016 Page: 181-205
Author(s): Sagarika Sahoo,Chandana Adhikari,Minati Kuanar,Bijay K. Mishra

Mapping Chemical Space Using Molecular Descriptors and Chemical Genetics: Deacetylase Inhibitors

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 7 Issue: 7 Year: 2004 Page: 669-676
Author(s): Stephen J. Haggarty, Paul A. Clemons, Jason C. Wong, Stuart L. Schreiber

Multivariate QSAR: From Classical Descriptors to New Perspectives

Journal: Current Computer-Aided Drug Design
Volume: 3 Issue: 4 Year: 2007 Page: 235-239
Author(s): Matheus P. Freitas

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

The Use of Molecular Descriptors in the Design of Gadolinium (III) Chelates as MRI Contrast Agents

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 3 Issue: 8 Year: 2003 Page: 845-859
Author(s): Alessandro Maiocchi

Research Article

MCDCalc: Markov Chain Molecular Descriptors Calculator for Medicinal Chemistry

Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 4 Year: 2020 Page: 305-317
Author(s): Paula Carracedo-Reboredo,Ramiro Corona,Mikel Martinez-Nunes,Carlos Fernandez-Lozano,Georgia Tsiliki,Haralambos Sarimveis,Eider Aranzamendi,Sonia Arrasate,Nuria Sotomayor,Esther Lete,Cristian Robert Munteanu,Humbert González-Díaz

Multimode Methods Applied on MIA Descriptors in QSAR

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 4 Year: 2008 Page: 273-282
Author(s): Matheus P. Freitas, Elaine F. F. da Cunha, Teodorico C. Ramalho, Mohammad Goodarzi

The WWW as a Tool to Obtain Molecular Parameters

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 3 Issue: 8 Year: 2003 Page: 809-820
Author(s): Igor V. Tetko

Chirality Descriptors in QSAR

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 4 Year: 2008 Page: 259-264
Author(s): Gordon M. Crippen

Small Molecule Databases and Chemical Descriptors Useful in Chemoinformatics: An Overview

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 6 Year: 2011 Page: 548-558
Author(s): Rafael Gozalbes, Antonio Pineda-Lucena

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