Search filters

List of works by Pramod C. Nair

A Fragment-Based Approach for the Computational Prediction of the Nonspecific Binding of Drugs to Hepatic Microsomes.

scientific article published on 19 August 2016

A novel function for UDP glycosyltransferase 8: galactosidation of bile acids.

scientific article published on 17 December 2014

An Automated Force Field Topology Builder (ATB) and Repository: Version 1.0

scientific article published on 15 November 2011

Arginine analogues incorporating carboxylate bioisosteric functions are micromolar inhibitors of human recombinant DDAH-1.

scientific article published on 30 September 2015

Arginine-259 of UDP-glycosyltransferase 2B7 (UGT2B7) confers UDP-sugar selectivity

scientific article published on 02 October 2020

CoMFA based de novo design of pyridazine analogs as PTP1B inhibitors

scientific article published on 24 October 2006

Comparative QSTR studies for predicting mutagenicity of nitro compounds

scientific article published on 28 June 2007

Comparison of enveloping distribution sampling and thermodynamic integration to calculate binding free energies of phenylethanolamine N-methyltransferase inhibitors

scientific article published in July 2011

Cytochrome P450 structure-function: insights from molecular dynamics simulations

scientific article

Fingerprint directed scaffold hopping for identification of CCR2 antagonists

scientific article published on 03 September 2008

Human UDP-Glucuronosyltransferase (UGT) 2B10: Validation of Cotinine as a Selective Probe Substrate, Inhibition by UGT Enzyme-Selective Inhibitors and Antidepressant and Antipsychotic Drugs, and Structural Determinants of Enzyme Inhibition

scientific article published on 15 December 2015

Insights into the UDP-sugar selectivities of human UDP-glycosyltransferases (UGT): a molecular modeling perspective

scientific article published on 5 August 2015

Letters to the Editor: Letter to the Editor regarding ‘A challenge to the dopamine orthodoxy in schizophrenia’

scientific article published in 2023

Missing Fragments: Detecting Cooperative Binding in Fragment-Based Drug Design

scientific article published on 12 April 2012

Molecular Field Analysis (MFA) and Other QSAR Techniques in Development of Phosphatase Inhibitors

scientific article published on January 1, 2011

Molecular dynamics simulations: from structure function relationships to drug discovery.

scientific article

Probing the structural and topological requirements for CCR2 antagonism: holographic QSAR for indolopiperidine derivatives

scientific article published in January 2008

QSAR studies on CCR2 antagonists with chiral sensitive hologram descriptors.

scientific article published on 11 January 2008

Quantitative structure activity relationship studies on thiourea analogues as influenza virus neuraminidase inhibitors

scientific article

The Expression Profiles of ADME Genes in Human Cancers and Their Associations with Clinical Outcomes

scientific article published on 13 November 2020

The Nonspecific Binding of Tyrosine Kinase Inhibitors to Human Liver Microsomes

scientific article

Using Theory to Reconcile Experiment: The Structural and Thermodynamic Basis of Ligand Recognition by Phenylethanolamine N-Methyltransferase (PNMT).

scientific article published on 30 March 2011

Warfarin resistance associated with genetic polymorphism of VKORC1: linking clinical response to molecular mechanism using computational modeling.

scientific article published on 28 October 2015