| Molecular insights into the interaction of RONS and Thieno [3, 2-c] pyran analogs with SIRT6/COX-2: a molecular dynamics study DK Yadav, S Kumar, S Misra, L Yadav, M Teli, P Sharma, S Chaudhary, ... Scientific reports 8 (1), 1-16, 2018 | 403 | 2018 |
| Molecular docking, QSAR and ADMET studies of withanolide analogs against breast cancer DK Yadav, S Kumar, HS Saloni, M Kim, P Sharma, S Misra, F Khan Drug design, development and therapy 11, 1859, 2017 | 77 | 2017 |
| Molecular dynamic simulations of oxidized skin lipid bilayer and permeability of reactive oxygen species DK Yadav, S Kumar, EH Choi, S Chaudhary, MH Kim Scientific reports 9 (1), 1-10, 2019 | 75 | 2019 |
| Prescription audit: experience in Garhwal (Uttaranchal), India RK Rishi, S Sangeeta, K Surendra, M Tailang Tropical doctor 33 (2), 76-79, 2003 | 69 | 2003 |
| Cold atmospheric plasma generated reactive species aided inhibitory effects on human melanoma cells: an in vitro and in silico study DK Yadav, M Adhikari, S Kumar, B Ghimire, I Han, MH Kim, EH Choi Scientific reports 10 (1), 1-15, 2020 | 57 | 2020 |
| SMPLIP-Score: predicting ligand binding affinity from simple and interpretable on-the-fly interaction fingerprint pattern descriptors S Kumar, M Kim Journal of cheminformatics 13 (1), 1-17, 2021 | 36 | 2021 |
| Studies of the benzopyran class of selective COX-2 inhibitors using 3D-QSAR and molecular docking DK Yadav, P Sharma, S Misra, H Singh, RL Mancera, K Kim, C Jang, ... Archives of pharmacal research 41 (12), 1178-1189, 2018 | 34 | 2018 |
| Insight into the molecular dynamic simulation studies of reactive oxygen species in native skin membrane DK Yadav, S Kumar, EH Choi, P Sharma, S Misra, MH Kim Frontiers in pharmacology 9, 644, 2018 | 32 | 2018 |
| Impact of plasma oxidation on structural features of human epidermal growth factor M Yusupov, JW Lackmann, J Razzokov, S Kumar, K Stapelmann, ... Plasma Processes and Polymers 15 (8), 1800022, 2018 | 30 | 2018 |
| Computational modeling on aquaporin-3 as skin cancer target: a virtual screening study DK Yadav, S Kumar, EH Choi, S Chaudhary, MH Kim Frontiers in chemistry 8, 250, 2020 | 26 | 2020 |
| Computational Modeling on Aquaporin-3 as Skin Cancer Target: A Virtual Screening and Molecular Dynamic Simulation Study DK Yadav, S Kumar, EH Choi, S Chaudhary, M Kim Preprints, 2019 | 26* | 2019 |
| Development of predictive models for identifying potential S100A9 inhibitors based on machine learning methods J Lee, S Kumar, SY Lee, SJ Park, M Kim Frontiers in chemistry 7, 779, 2019 | 22 | 2019 |
| Molecular targets for malarial chemotherapy: a review DK Yadav, S Kumar, MK Teli, R Yadav, S Chaudhary Current topics in medicinal chemistry 19 (10), 861-873, 2019 | 22 | 2019 |
| Ligand‐based pharmacophore modeling and docking studies on vitamin D receptor inhibitors DK Yadav, S Kumar, MK Teli, MH Kim Journal of cellular biochemistry 121 (7), 3570-3583, 2020 | 21 | 2020 |
| Classification of carcinogenic and mutagenic properties using machine learning method NSHN Moorthy, S Kumar, V Poongavanam Computational Toxicology 3, 33-43, 2017 | 20 | 2017 |
| Structural optimization of new class of selective carbonic anhydrase inhibitors: QSAR approach B Pothen, V Singh, S Kumar, M Tiwari CSIR, 2010 | 19 | 2010 |
| Design, synthesis, computational and biological evaluation of new benzodiazepines as CNS agents S Verma, S Kumar, S Kumar Arabian Journal of Chemistry 13 (1), 863-874, 2020 | 18 | 2020 |
| Electric-field-induced electroporation and permeation of reactive oxygen species across a skin membrane DK Yadav, S Kumar, EH Choi, MH Kim Journal of Biomolecular Structure and Dynamics 39 (4), 1343-1353, 2021 | 16 | 2021 |
| Discovery of Aporphine analogues as potential antiplatelet and antioxidant agents: design, synthesis, structure–activity relationships, biological evaluations, and in silico … V Sharma, PK Jaiswal, S Kumar, M Mathur, AK Swami, DK Yadav, ... ChemMedChem 13 (17), 1817-1832, 2018 | 16 | 2018 |
| Topomer-CoMFA-based predictive modelling on 2, 3-diaryl-substituted-1, 3-thiazolidin-4-ones as non-nucleoside reverse transcriptase inhibitors S Kumar, M Tiwari Medicinal Chemistry Research 24 (1), 245-257, 2015 | 15 | 2015 |
Dr. (Mrs.) Meena TiwariProfessor, Department of Pharmacy, Shri. G. S. Instutute of Technology & Science, IndoreVerified email at sgsits.ac.in
