| E-pharmacophore modelling, virtual screening, molecular dynamics simulations and in-silico ADME analysis for identification of potential E6 inhibitors against cervical cancer A Kumar, E Rathi, SG Kini Journal of Molecular Structure 1189, 299-306, 2019 | 62 | 2019 |
| A recent appraisal of artificial intelligence and in silico ADMET prediction in the early stages of drug discovery A Kumar, E Rathi, SG Kini Mini Reviews in Medicinal Chemistry, 2021 | 27 | 2021 |
| Repurposing of existing FDA approved drugs for Neprilysin inhibition: an in-silico study KA Runali Sankhe, Ekta Rathi, Suman Manandhar, Avinash Kumar, KSR Pai ... Journal of Molecular Structure, 2020 | 25* | 2020 |
| 1,8-Naphthyridine derivatives: A privileged scaffold for versatile biological activities M Ojha, D Yadav, A Kumar, S Dasgupta, R Yadav Mini Reviews in Medicinal Chemistry, 2020 | 19 | 2020 |
| Identification of potential tumour-associated carbonic anhydrase isozyme IX inhibitors: atom-based 3D-QSAR modelling, pharmacophore-based virtual screening and molecular … A Kumar, E Rathi, SG Kini Journal of Biomolecular Structure and Dynamics, 2019 | 19 | 2019 |
| Computational approaches in efflux pump inhibitors: current status and prospects E Rathi, A Kumar, SG Kini Drug Discovery Today, 2020 | 17 | 2020 |
| Molecular dynamics guided insight, binding free energy calculations and pharmacophore-based virtual screening for the identification of potential VEGFR2 inhibitors E Rathi, A Kumar, SG Kini Journal of Receptors and Signal Transduction 39 (5-6), 415-433, 2019 | 15 | 2019 |
| Is viral E6 oncoprotein a viable target? A critical analysis in the context of cervical cancer A Kumar, E Rathi, R C, H, SG Kini Medicinal Research Reviews, 2020 | 14 | 2020 |
| Pharmacophore-guided fragment-based design of novel mammalian target of rapamycin inhibitors: extra precision docking, fingerprint-based 2D and atom-based 3D-QSAR modelling A Kumar, S Rai, E Rathi, P Agarwal, SG Kini Journal of Biomolecular Structure and Dynamics 39 (4), 1155-1173, 2021 | 13 | 2021 |
| Potentials of diphenyl ether scaffold as a therapeutic agent: A review SG Kini, E Rathi, A Kumar, V Bhat Mini reviews in medicinal chemistry 19 (17), 1392-1406, 2019 | 11 | 2019 |
| Identification of E6 Inhibitors Employing EnergeticallyOptimized Structure-Based Pharmacophore Modelling,Ligand Docking and Molecular Dynamics SimulationsStudies A Kumar, E Rathi, SG Kini ChemistrySelect 4 (36), 10701-10708, 2019 | 11 | 2019 |
| Drug repurposing approach for the identification and designing of potential E6 inhibitors against cervical cancer: an in silico investigation A Kumar, E Rathi, SG Kini Structural Chemistry, 2019 | 11 | 2019 |
| Phytoestrogenic Potential of Resveratrol by Selective Activation of Estrogen Receptor-α in Osteoblast Cells AA Shah, A Shah, A Kumar, A Lakra, D Singh, Y Nayak Revista Brasileira de Farmacognosia 32 (2), 248-256, 2022 | 7 | 2022 |
| Identification of potent HDAC 2 inhibitors using E-pharmacophore modelling, structure-based virtual screening and molecular dynamic simulation P Pai, A Kumar, MG Shetty, SG Kini, MB Krishna, K Satyamoorthy, ... Journal of Molecular Modeling 28 (5), 119, 2022 | 6 | 2022 |
| e-Pharmacophore model-guided design of potential DprE1 inhibitors: synthesis, in vitro antitubercular assay and molecular modelling studies A Kumar, R Rajappan, SG Kini, E Rathi, S Pai, S Dharamrajan Chemical Papers, 2021 | 6 | 2021 |
| Computer-aided identification of human carbonic anhydrase isoenzyme VII inhibitors as potential antiepileptic agents A Kumar, E Rathi, SG Kini Journal of Biomolecular Structure and Dynamics, 2020 | 6 | 2020 |
| Exploration of small-molecule entry disruptors for chikungunya virus by targeting matrix remodelling associated protein A Kumar, E Rathi, SG Kini Research in Pharmaceutical Sciences 15 (3), 300, 2020 | 6 | 2020 |
| Targeting HIV‐TB coinfection by developing novel piperidin‐4‐substituted imines: Design, synthesis, in vitro and in silico studies A Kumar, R Revathi, D Sriram, F Curreli, AK Debnath, KS Pai, SG Kini Archiv der Pharmazie 352 (6), 1800358, 2019 | 6 | 2019 |
| Design, synthesis, extra-precision docking, and molecular dynamics simulation studies of pyrrolidin-2-one derivatives as potential acetylcholinesterase inhibitors M Gupta, A Kumar, C Prasun, MS Nair, SG Kini, D Yadav, S Nain Journal of Biomolecular Structure and Dynamics 41 (13), 6282-6294, 2023 | 5 | 2023 |
| Identification of potential DNA gyrase inhibitors: virtual screening, extra-precision docking and molecular dynamics simulation study A Kumar, C Prasun, E Rathi, MS Nair, SG Kini Chemical Papers 77 (11), 6717-6727, 2023 | 2 | 2023 |
Suvarna KiniProfessor, Manipal College of Pharm. Sciences, Manipal University,Verified email at manipal.edu
