CW Yap, Y Xue, H Li, ZR Li, CY Ung… - Mini Reviews in …, 2006 - ingentaconnect.com
Computational methods for predicting compounds of specific pharmacodynamic, pharmacokinetic, or toxicological property are useful for facilitating drug discovery and drug …
A Vaidya, S Jain, S Jain, AK Jain… - Journal of …, 2014 - ingentaconnect.com
Quantitative structure-activity relationships (QSAR) play a central role in computational molecular modeling methodologies, since last two decade. QSARs are cheaper and rapid …
Abstract Quantitative Structure Activity Relationship (QSAR) are mathematical models that seek to predict complicated physicochemical/biological properties of chemicals from their …
C Isarankura-Na-Ayudhya, T Naenna, C Nantasenamat… - 2009 - core.ac.uk
Quantitative structure-activity relationship (QSAR) modeling pertains to the construction of predictive models of biological activities as a function of structural and molecular information …
K Roy, P Chakraborty, I Mitra, PK Ojha… - Journal of …, 2013 - Wiley Online Library
Quantitative structure–activity relationship (QSAR) techniques have found wide application in the fields of drug design, property modeling, and toxicity prediction of untested chemicals …
PM Khan, K Roy - Expert opinion on drug discovery, 2018 - Taylor & Francis
Introduction: Quantitative structure-activity/property relationships (QSAR/QSPR) are statistical models which quantitatively correlate quantitative chemical structure information …
LC Yee, YC Wei - … modelling of molecular descriptors in QSAR …, 2012 - Wiley Online Library
A drug company has to ensure the quality, safety, and efficacy of a marketed drug by subjecting the drug to a variety of tests [1]. Therefore, drug development is a time-consuming …
K Roy, S Kar, RN Das, K Roy, S Kar, RN Das - A Primer on QSAR/QSPR …, 2015 - Springer
Abstract Development of predictive quantitative structure–activity relationship (QSAR) models plays a significant role in the design of purpose-specific fine chemicals including …
K Roy, S Kar - Frontiers in computational chemistry, 2015 - Elsevier
Quantitative structure-activity relationship (QSAR) is a statistical modelling approach that can be used in drug discovery, environmental fate modeling, property and activity prediction …