| Activity of phytochemical constituents of black pepper, ginger, and garlic against coronavirus (COVID-19): an in silico approach K Rajagopal, G Byran, S Jupudi, R Vadivelan Int J Health Allied Sci 9 (5), 43-50, 2020 | 85 | 2020 |
| Identification of some novel oxazine substituted 9-anilinoacridines as SARS-CoV-2 inhibitors for COVID-19 by molecular docking, free energy calculation and molecular dynamics … K Rajagopal, P Varakumar, B Aparna, G Byran, S Jupudi Journal of Biomolecular Structure and Dynamics 39 (15), 5551-5562, 2021 | 30 | 2021 |
| Screening of in vitro antiinflammatory activity of some newly synthesized 1, 3-thiazine derivatives S Jupudi, S Talari, D Karunakaram, R Govindarajan Int J Res Pharm Chem 3 (2), 213-20, 2013 | 30 | 2013 |
| Combining molecular docking and molecular dynamics studies for modelling Staphylococcus aureus MurD inhibitory activity MA Azam, S Jupudi, N Saha, RK Paul SAR and QSAR in Environmental Research 30 (1), 1-20, 2019 | 21 | 2019 |
| Pharmacophore modeling, atom based 3D-QSAR, molecular docking and molecular dynamics studies on Escherichia coli ParE inhibitors MA Azam, J Thathan, S Jupudi Computational biology and chemistry 84, 107197, 2020 | 18 | 2020 |
| Structure-based virtual screening to identify inhibitors against Staphylococcus aureus MurD enzyme MA Azam, S Jupudi Structural Chemistry 30 (6), 2123-2133, 2019 | 15 | 2019 |
| Pharmacophore generation, atom-based 3D-QSAR, molecular docking and molecular dynamics simulation studies on benzamide analogues as FtsZ inhibitors S Tripathy, MA Azam, S Jupudi, SK Sahu Journal of Biomolecular Structure and Dynamics 36 (12), 3218-3230, 2018 | 15 | 2018 |
| Extra precision docking, free energy calculation and molecular dynamics studies on glutamic acid derivatives as MurD inhibitors MA Azam, S Jupudi Computational Biology and Chemistry 69, 55-63, 2017 | 14 | 2017 |
| A new pyrimidine alkaloid from the roots of Tadehagi triquetrum (L.) H.Ohashi Vedpal, S Jupudi, S Jubie, NP Deepika, SP Dhanabal Natural product research 35 (3), 413-420, 2021 | 13 | 2021 |
| Identification of Papain-Like Protease inhibitors of SARS CoV-2 through HTVS, Molecular docking, MMGBSA and Molecular dynamics approach S Jupudi, K Rajagopal, S Murugesan, BK Kumar, K Raman, G Byran, ... South African Journal of Botany 151, 82-91, 2022 | 10 | 2022 |
| Dipeptidyl peptidase-IV inhibitory action of Calebin A: an in silico and in vitro analysis NSS Chalichem, S Jupudi, VR Yasam, D Basavan Journal of Ayurveda and Integrative Medicine 12 (4), 663-672, 2021 | 9 | 2021 |
| DFT calculation, molecular docking, and molecular dynamics simulation study on substituted phenylacetamide and benzohydrazide derivatives V Yele, DK Sigalapalli, S Jupudi, AA Mohammed Journal of Molecular Modeling 27 (12), 359, 2021 | 8 | 2021 |
| Ligand-based pharmacophore modelling, in silico virtual screening, molecular docking and molecular dynamic simulation study to identify novel Francisella tularensis ParE inhibitors V Yele, MA Azam, S Jupudi Chemical Papers 74, 4567-4580, 2020 | 8 | 2020 |
| A New Class Of Pure Estrogen Alpha Receptor Antagonists; Design, Synthesis And In-Vitro Screening MAAPD Jameera Begam A, Basheer A, Selvaraj Jubie, Srikanth Jupudi Letters in Drug Design & Discovery, 2018 | 8* | 2018 |
| Insight into the structural requirements of thiophene-3-carbonitriles-based MurF inhibitors by 3D-QSAR, molecular docking and molecular dynamics study MA Azam, S Jupudi Journal of Receptors and Signal Transduction 37 (5), 522-534, 2017 | 8 | 2017 |
| An overview on versatile molecule: 1, 3-thiazines S Jupudi, K Padmini, PJ Preethi, PVP Bharadwaj, PV Rao Asian Journal of Research in Pharmaceutical Science 3 (4), 170-177, 2013 | 8 | 2013 |
| Ligand-based pharmacophore modeling and molecular dynamic simulation approaches to identify putative MMP-9 inhibitors BKR Sanapalli, V Yele, S Jupudi, VVSR Karri RSC advances 11 (43), 26820-26831, 2021 | 7 | 2021 |
| Computer-aided identification of lead compounds as Staphylococcal epidermidis FtsZ inhibitors using molecular docking, virtual screening, DFT analysis, and … S Tripathy, SK Sahu, MA Azam, S Jupudi Journal of Molecular Modeling 25, 1-13, 2019 | 7 | 2019 |
| Antifungal and anti-termite activities, total phenolic content of Prosopis farcta extracts; attempts to develop weed biocontrol method against it A Azab European chemical bulletin 7 (10), 293-302, 2018 | 6 | 2018 |
| Identification of antimycobacterial agent using in silico virtual screening, ADME prediction, docking, and molecular dynamics simulations approach S Tripathy, SK Sahu, MA Azam, S Jupudi, VK Gupta, S Sharma Current Computer-aided Drug Design 17 (6), 806-816, 2021 | 5 | 2021 |
