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Methods in Molecular Biology (Clifton, N.J.)|March 30, 2018
De Novo Design of Ligands Using Computational MethodsVenkatesan Suryanarayanan, Umesh Panwar, Ishwar Chandra, et al.Journal of Biomolecular Structure & Dynamics|July 26, 2018
Deciphering the binding mode and mechanistic insights of pentadecylidenemalonate (1b) as activator of histone acetyltransferase PCAFVenkatesan Suryanarayanan, Sanjeev Kumar SinghJournal of Biomolecular Structure & Dynamics|December 13, 2017
Unravelling novel congeners from acetyllysine mimicking ligand targeting a lysine acetyltransferase PCAF bromodomainVenkatesan Suryanarayanan, Sanjeev Kumar SinghJournal of Receptor and Signal Transduction Research|November 19, 2014
Assessment of dual inhibition property of newly discovered inhibitors against PCAF and GCN5 through in silico screening, molecular dynamics simulation and DFT approachVenkatesan Suryanarayanan, Sanjeev Kumar SinghEndocrine, Metabolic & Immune Disorders Drug Targets|November 29, 2018
Identification of Novel Pancreatic Lipase Inhibitors Using In Silico StudiesUmesh Panwar, Sanjeev Kumar SinghComputational Biology and Chemistry|June 21, 2021
In silico virtual screening of potent inhibitor to hamper the interaction between HIV-1 integrase and LEDGF/p75 interaction using E-pharmacophore modeling, molecular docking, and dynamics simulationsUmesh Panwar, Sanjeev Kumar SinghJournal of Biomolecular Structure & Dynamics|September 27, 2017
Structure-based virtual screening toward the discovery of novel inhibitors for impeding the protein-protein interaction between HIV-1 integrase and human lens epithelium-derived growth factor (LEDGF/p75)Umesh Panwar, Sanjeev Kumar SinghMethods in Molecular Biology (Clifton, N.J.)|September 7, 2023
Exploring the Role of Chemoinformatics in Accelerating Drug Discovery: A Computational ApproachAarthy Murali, Umesh Panwar, Sanjeev Kumar SinghScientific Reports|May 28, 2020
Structural dynamic studies on identification of EGCG analogues for the inhibition of Human Papillomavirus E7Murali Aarthy, Umesh Panwar, Sanjeev Kumar SinghMolecular Diversity|October 23, 2021
Artificial intelligence and machine learning approaches for drug design: challenges and opportunities for the pharmaceutical industriesChandrabose Selvaraj, Ishwar Chandra, Sanjeev Kumar SinghPageof 26