Structure-Based Identification of Potential Drugs Against FmtA of Staphylococcus aureus: Virtual Screening, Molecular Dynamics, MM-GBSA, and QM/MM V Dalal, P Dhankhar, V Singh, V Singh, G Rakhaminov, D Golemi-Kotra, ... The protein journal 40, 148-165, 2021 | 98 | 2021 |
Structure of dye-decolorizing peroxidase from Bacillus subtilis in complex with veratryl alcohol P Dhankhar, V Dalal, V Singh, AK Sharma, P Kumar International Journal of Biological Macromolecules 193, 601-608, 2021 | 33 | 2021 |
Multifunctional inhibitors of SARS-CoV-2 by MM/PBSA, essential dynamics, and molecular dynamic investigations KA Kumar, M Sharma, V Dalal, V Singh, S Tomar, P Kumar Journal of Molecular Graphics and Modelling 107, 107969, 2021 | 32 | 2021 |
Virus-host protein-protein interactions as molecular drug targets for arboviral infections M Bhutkar, V Singh, P Dhaka, S Tomar Frontiers in Virology 2, 959586, 2022 | 13 | 2022 |
Elucidation of antiviral mechanisms of natural therapeutic molecules Herbacetin and Caffeic acid phenethyl ester against chikungunya and dengue virus M Bhutkar, R Rani, A Pathak, A Kothiala, S Mahajan, B Waghmode, ... bioRxiv, 2022.05. 31.494145, 2022 | 4 | 2022 |
Structure-guided mutations in CDRs for enhancing the affinity of neutralizing SARS-CoV-2 nanobody V Singh, M Bhutkar, S Choudhary, S Nehul, R Kumar, J Singla, P Kumar, ... Biochemical and Biophysical Research Communications 734, 150746, 2024 | 3 | 2024 |
Molecular docking and simulation study to identify novel potent inhibitors against FmtA in Staphylococcus aureus V Singh, V Dalal, P Dhankhar, DG Kotra, P Kumar Proceedings of International Conference on Drug Discovery (ICDD), 2020 | 2 | 2020 |
Designing and bioengineering of CDRs with higher affinity against receptor-binding domain (RBD) of SARS-CoV-2 Omicron variant V Singh, S Choudhary, M Bhutkar, S Nehul, S Ali, J Singla, P Kumar, ... International Journal of Biological Macromolecules, 138751, 2024 | 1 | 2024 |
Enhancing affinity of neutralizing SARS-CoV-2 nanobody through facile structure-guided mutations in CDRs V Singh, M Bhutkar, S Choudhary, S Nehul, R Kumar, J Singla, P Kumar, ... bioRxiv, 2024.05. 13.593833, 2024 | 1 | 2024 |
High altitude-induced oxidative stress, rheumatoid arthritis, and proteomic alteration V Dalal, V Singh, S Biswas High Altitude Sickness–Solutions from Genomics, Proteomics and Antioxidant …, 2022 | 1 | 2022 |
Optimized high-yield expression of envelope glycoprotein domain III from dengue virus serotypes 1 to 4 D Mallick, V Tyagi, A Saroj, M Bhutkar, V Kumar, M Das, R Madhukalya, ... Biochimie, 2024 | | 2024 |
Mechanistic insights into the inhibition of dengue virus NS5 methyltransferase by herbacetin M Bhutkar, S Verma, V Singh, P Kumar, S Tomar bioRxiv, 2024.10. 14.618121, 2024 | | 2024 |