Guanidine-based β amyloid precursor protein cleavage enzyme 1 (BACE-1) inhibitors for the Alzheimer's disease (AD): a review P Gehlot, S Kumar, VK Vyas, BS Choudhary, M Sharma, R Malik Bioorganic & Medicinal Chemistry 74, 117047, 2022 | 32 | 2022 |
Molecular docking and molecular dynamics simulation based approach to explore the dual inhibitor against HIV-1 reverse transcriptase and Integrase SM Subhash Chander, Rajan Kumar Pandey, Ashok Penta, Bhanwar Singh Choudhary ... Combinatorial Chemistry & High Throughput Screening 20, 2017 | 25 | 2017 |
Structure-based screening, ADMET profiling, and molecular dynamic studies on mGlu2 receptor for identification of newer antiepileptic agents R Malik, P Mehta, S Srivastava, BS Choudhary, M Sharma Journal of Biomolecular Structure and Dynamics 35 (16), 3433-3448, 2017 | 18 | 2017 |
Identification of chemically diverse GABAA agonists as potential anti-epileptic agents using structure-guided virtual screening, ADMET, quantum mechanics and clinical … P Mehta, S Srivastava, M Sharma, I Singh, R Malik International Journal of Biological Macromolecules 119, 1113-1128, 2018 | 16 | 2018 |
Identification of novel acetylcholinesterase inhibitors through e-pharmacophore-based virtual screening and molecular dynamics simulations R Malik, BS Choudhary, S Srivastava, P Mehta, M Sharma Journal of Biomolecular Structure and Dynamics 35 (15), 3268-3284, 2017 | 14 | 2017 |
Pharmacophore modeling, 3D-QSAR and in silico ADMET prediction of N-pyridyl and pyrimidine benzamides as potent antiepileptic agents BCMS Ruchi Malik, Pakhuri Mehta, Shubham Srivastava Journal of Receptors and Signal Transduction 37 (3), 259-266, 2017 | 14 | 2017 |
Computational Design of Phosphatidylinositol 3-Kinase (PI3K) Inhibitors MSI Rani ASSAY and Drug Development Technologies, 2022 | 13 | 2022 |
N-(4-Hydroxyphenyl)-3,4,5-trimethoxybenzamide derivatives as potential memory enhancers: synthesis, biological evaluation and molecular simulation studies P Piplani, M Sharma, P Mehta, R Malik Journal of Biomolecular Structure and Dynamics 36 (7), 1867-1877, 2018 | 11 | 2018 |
High throughput virtual screening and in-silico ADMET analysis for rapid and efficient identification of potential PAP248-286 aggregation inhibitors as anti-HIV agents MS Ruchi Malik, Devendra Bunkar, Bhanwar Singh Choudhary, Shubham Srivastava ... Journal of Molecular Structure., 239-246, 2016 | 11 | 2016 |
An appraisal on synthetic and medicinal aspects of fused pyrimidines as anti neoplastic agents I Rani, N Kaur, A Goyal, M Sharma Anti-Cancer Agents in Medicinal Chemistry (Formerly Current Medicinal …, 2023 | 10 | 2023 |
Design, synthesis and biological evaluation of selected 3-[3-(amino) propoxy] benzenamines as acetylcholinesterase inhibitors R Malik, R Gupta, S Srivastava, BS Choudhary, M Sharma Journal of Biomolecular Structure and Dynamics 35 (11), 2382-2394, 2017 | 9 | 2017 |
Dual Allosteric Effect in Glycine/NMDA Receptor Antagonism: A Molecular Docking Simulation Approach M Sharma, VB Gupta International Journal of Drug Design and Discovery 3 (1), 718-730, 2012 | 9 | 2012 |
Dual allosteric effect in glycine/NMDA receptor antagonism: a comparative QSAR approach M Sharma, VB Gupta Pharmaceuticals 3 (10), 3167-3185, 2010 | 7 | 2010 |
Pharmacophore modeling and 3D-QSAR studies of galloyl benzamides as potent P-gp inhibitors MSRM Shubham Srivastava, Bhanwar Singh Choudhary Medicinal Chemistry Research 25 (6), 1140-1147, 2016 | 6 | 2016 |
Determination of comprehensive in silico determinants as a strategy for identification of novel PI3Kα inhibitors S Srivastava, A Vengamthodi, I Singh, BS Choudhary, M Sharma, R Malik Structural Chemistry 30, 1761-1778, 2019 | 5 | 2019 |
Computationally guided identification of Akt-3, a serine/threonine kinase inhibitors: Insights from homology modelling, structure-based screening, molecular dynamics and … S Srivastava, P Mehta, O Sharma, M Sharma, R Malik Journal of Biomolecular Structure and Dynamics 38 (14), 4179-4188, 2020 | 4 | 2020 |
Discovery of novel chemotypes for competitive AMPA receptor antagonists as potential antiepileptic agents through structure-based virtual screening of natural products library P Mehta, S Srivastava, M Sharma, R Malik Structural Chemistry 30, 1159-1172, 2019 | 4 | 2019 |
Molecular dynamics insights for PI3K-δ inhibition & structure guided identification of novel PI3K-δ inhibitors S Srivastava, B Singh Choudhary, P Mehta, Sukanya, M Sharma, R Malik Journal of Biomolecular Structure and Dynamics 37 (9), 2404-2414, 2019 | 4 | 2019 |
Synthesis, characterization, and pharmacological evaluation of benzothiopyran derivatives as a novel class of calcium channel blockers R Nalwaya, A Sahai, S Chander, M Sharma, R Malik, G Sarsodia Medicinal Chemistry Research 22 (5), 2188-2195, 2013 | 4 | 2013 |
Probing voltage sensing domain of KCNQ2 channel as a potential target to combat epilepsy: a comparative study RM Pakhuri Mehta, Shubham Srivastava, Bhanwar Singh Choudhary, Manish Sharma Journal of Receptors and Signal Transduction, 2017 | 3 | 2017 |