| Investigation of the effect of temperature on the structure of SARS-Cov-2 Spike Protein by Molecular Dynamics Simulations SL Rath, K Kumar Frontiers of Molecular Biosciences 7 (583523), 297, 2020 | 77 | 2020 |
| Accelerating COVID-19 research using molecular dynamics simulation AK Padhi, SL Rath, T Tripathi The Journal of Physical Chemistry B 125 (32), 9078-9091, 2021 | 64 | 2021 |
| Scanning the RBD-ACE2 molecular interactions in Omicron variant SL Rath, AK Padhi, N Mandal Biochemical and Biophysical Research Communications 592, 18-23, 2022 | 57 | 2022 |
| Molecular insights into the differential dynamics of SARS-CoV-2 variants of concern N Mandal, AK Padhi, SL Rath Journal of Molecular Graphics and Modelling 114, 108194, 2022 | 28 | 2022 |
| Computational drug re-purposing targeting the spike glycoprotein of SARS-CoV-2 as an effective strategy to neutralize COVID-19 HG Toor, DI Banerjee, SL Rath, SA Darji European Journal of Pharmacology 890, 173720, 2021 | 25 | 2021 |
| Mechanism of p27 Unfolding for CDK2 Reactivation SL Rath, S Senapati Scientific Reports 6, 1, 2016 | 19 | 2016 |
| Why are the truncated cyclin Es more effective CDK2 activators than the full-length isoforms? SL Rath, S Senapati Biochemistry 53 (28), 4612-4624, 2014 | 18 | 2014 |
| Molecular basis of differential selectivity of cyclobutyl-substituted imidazole inhibitors against CDKs: insights for rational drug design SL Rath, S Senapati PloS one 8 (9), e73836, 2013 | 13 | 2013 |
| Identification of factors promoting HBV capsid self-assembly by assembly-promoting antivirals SL Rath, H Liu, S Okazaki, W Shinoda Journal of Chemical Information and Modeling 58 (2), 328-337, 2018 | 12 | 2018 |
| MoS 2 nanosheets effectively bind to the receptor binding domain of the SARS-CoV-2 spike protein and destabilize the spike–human ACE2 receptor interactions D Bisht, SL Rath, S Roy, A Jaiswal Soft Matter 18 (47), 8961-8973, 2022 | 7 | 2022 |
| How does temperature affect the dynamics of SARS-CoV-2 M proteins? Insights from molecular dynamics simulations SL Rath, M Tripathy, N Mandal The Journal of Membrane Biology 255 (2), 341-356, 2022 | 6 | 2022 |
| Computational studies reveal Fluorine based quinolines to be potent inhibitors for proteins involved in SARS-CoV-2 assembly N Sarkar, A Thakur, J Ghadge, SL Rath Journal of Fluorine Chemistry 250, 109865, 2021 | 4 | 2021 |
| Ni (ii)-polypyridyl complexes as potential DNA binders P Sahni, R Gupta, D Tripathy, SL Rath, AK Pal New Journal of Chemistry 47 (31), 14717-14725, 2023 | 3 | 2023 |
| An Unsupervised Clustering Algorithm to Cluster the New SARS-CoV-2 Virus Mutation SL Rath, C Sinha, SLNP Kasturi, S Mohapatra, K Jain Innovations in Computer Science and Engineering (Proceedings of the Ninth …, 2022 | 3 | 2022 |
| Synthesis, characterization and molecular docking study of Nitro (4′-(2-pyridyl)-2, 2′: 6′, 2 ″-terpyridyl) Palladium (II) nitrate D Tripathy, AK Pal, SL Rath, GS Hanan, BB Panda, DK Chand Inorganic Chemistry Communications 126, 108494, 2021 | 3 | 2021 |
| Identifying Antibiotic-Resistant Mutants in β-Lactamases for Class A and Class B Using Unsupervised Machine Learning SL Rath, S Mohapatra, V Gayathri Engineering Proceedings 59 (1), 146, 2024 | 2 | 2024 |
| Platinum (II) based macrocyclic host for recognition of aromatic hydrocarbons D Tripathy, SL Rath, NB Debata, AK Pal, DK Chand, GS Hanan Journal of Molecular Structure 1292, 136104, 2023 | 2 | 2023 |
| Hierarchical self-assembly of self-assembled Pd (II) complexes: Synthesis, structural characterization, crystal packing evaluation and docking studies D Tripathy, S Ganta, SL Rath, DK Chand Journal of Molecular Structure 1259, 132767, 2022 | 2 | 2022 |
| Protein structure visualization S Kaushik, SL Rath Academic Press, 2019 | 2 | 2019 |
| Delineating the Structure–Dynamics–Binding Differences among BA. 1, BA. 4/5, and BF. 7 SARS-CoV-2 Variants through Atomistic Simulations: Correlation with Structural and … A Joshi, S Maurya, A Mahale, SL Rath, T Tripathi, AK Padhi ACS omega 8 (41), 37852-37863, 2023 | 1 | 2023 |
NABANITA MANDALPost Doctoral Fellow, Lund UniversityEmail verificata su compchem.lu.se