Molecular docking and molecular dynamic studies: screening of phytochemicals against EGFR, HER2, estrogen and NF-KB receptors for their potential use in breast cancer GS Purawarga Matada, PS Dhiwar, N Abbas, E Singh, A Ghara, A Das, ... Journal of Biomolecular Structure and Dynamics 40 (13), 6183-6192, 2022 | 22 | 2022 |
Management of COVID-19-induced cytokine storm by Keap1-Nrf2 system: a r eview E Singh, GSP Matada, N Abbas, PS Dhiwar, A Ghara, A Das Inflammopharmacology 29 (5), 1347-1355, 2021 | 22 | 2021 |
DDR1 and DDR2: a review on signaling pathway and small molecule inhibitors as an anticancer agent GSP Matada, A Das, PS Dhiwar, A Ghara Medicinal Chemistry Research 30 (3), 535-551, 2021 | 22 | 2021 |
Discovery of potential Aurora-A kinase inhibitors by 3D QSAR pharmacophore modeling, virtual screening, docking, and MD simulation studies G Swamy PM, N Abbas, PS Dhiwar, E Singh, A Ghara, A Das Journal of Biomolecular Structure and Dynamics 41 (1), 125-146, 2023 | 7 | 2023 |
Molecular recognition of some novel mTOR kinase inhibitors to develop anticancer leads by drug-likeness, molecular docking and molecular dynamics based virtual screening strategy A Das, GSP Matada, PS Dhiwar, NM Raghavendra, N Abbas, E Singh, ... Computational Toxicology 25, 100257, 2023 | 3 | 2023 |
Regioselective Decarboxylative Transformations of Tetrahydro-β-carboline-1-carboxylic Acid: Reagent Controlled Selectivity toward Alkynylated or Enaminone Products A Das, C Jonathan, R Saha, MI Ahmed, S Bhowmik Organic Letters 25 (40), 7310-7315, 2023 | 1 | 2023 |
Virtual screening of few novel Sulindac derivatives as multi-targeted agents A Das, S Nandi, K Das, S Banerjee Drug Discov 14 (33), 33-43, 2020 | 1 | 2020 |
Reprofiling the Antidiabetic Drugs to Restrict SARS-CoV-2: An In-Silico Approach A Barik, A Das, P Sasmal Drug Discovery 58 (321), 953-956, 2022 | | 2022 |
Design and discovery of some novel protease inhibitors against SARS-CoV-2 main protease by molecular docking, drug-likeness and ADME studies: An in-silico approach A Das, S Banerjee, KK Sen International Pharmacy Acta 4 (1), 4e9: 1-13, 2021 | | 2021 |
Design, synthesis, and evaluation of 1, 4-benzothiazine-3-one containing bis-amide derivatives as dual inhibitors of Staphylococcus aureus with plausible application in urinary … K Naithani, A Das, M Ushare, S Nath, R Biswas, A Kundu, KT Ahmed, ... Frontiers in Chemistry 12, 1420593, 0 | | |