Choline Chloride as a Nano‐Crowder Protects HP‐36 from Urea‐Induced Denaturation: Insights from Solvent Dynamics and Protein‐Solvent Interactions A Maity, S Sarkar, L Theeyancheri, R Chakrabarti ChemPhysChem 21 (6), 552-567, 2020 | 28 | 2020 |
Microscopic structural features of water in aqueous–reline mixtures of varying compositions S Sarkar, A Maity, R Chakrabarti Physical Chemistry Chemical Physics 23 (6), 3779-3793, 2021 | 20 | 2021 |
Salt induced structural collapse, swelling, and signature of aggregation of two ssDNA strands: insights from molecular dynamics simulation S Sarkar, A Maity, A Sarma Phukon, S Ghosh, R Chakrabarti The Journal of Physical Chemistry B 123 (1), 47-56, 2018 | 17 | 2018 |
Dynamics of Bcl-xL in water and membrane: molecular simulations A Maity, S Yadav, CS Verma, S Ghosh Dastidar PLoS One 8 (10), e76837, 2013 | 17 | 2013 |
The long unstructured region of Bcl‐xl modulates its structural dynamics P Priya, A Maity, S Ghosh Dastidar Proteins: Structure, Function, and Bioinformatics 85 (8), 1567-1579, 2017 | 13 | 2017 |
Computational design of stapled peptide inhibitor against SARS‐CoV‐2 receptor binding domain AR Choudhury, A Maity, S Chakraborty, R Chakrabarti Peptide Science 114 (5), e24267, 2022 | 11 | 2022 |
In silico elucidation of molecular picture of water–choline chloride mixture S Sarkar, A Maity, R Chakrabarti The Journal of Physical Chemistry B 125 (48), 13212-13228, 2021 | 11 | 2021 |
Flexibility enables to discriminate between ligands: Lessons from structural ensembles of Bcl-xl and Mcl-1 A Maity, S Majumdar, SG Dastidar Computational Biology and Chemistry 77, 17-27, 2018 | 11 | 2018 |
Adaptability in protein structures: Structural dynamics and implications in ligand design A Maity, S Majumdar, P Priya, P De, S Saha, S Ghosh Dastidar Journal of Biomolecular Structure and Dynamics 33 (2), 298-321, 2015 | 11 | 2015 |
Effect of Stapling on the Thermodynamics of mdm2–p53 Binding A Maity, AR Choudhury, R Chakrabarti Journal of Chemical Information and Modeling 61 (4), 1989-2000, 2021 | 10 | 2021 |
Interactions between Bcl-xl and its inhibitors: Insights into ligand design from molecular dynamics simulation P Priya, A Maity, S Majumdar, SG Dastidar Journal of Molecular Graphics and Modelling 59, 1-13, 2015 | 10 | 2015 |
A systematic drug repurposing approach to identify promising inhibitors from FDA-approved drugs against Nsp4 protein of SARS-CoV-2 J Chakraborty, A Maity, H Sarkar Journal of Biomolecular Structure and Dynamics 41 (2), 550-559, 2021 | 7 | 2021 |
BIM binding remotely regulates BAX activation: insights from the free energy landscapes S Sinha, A Maity, S Ghosh Dastidar Journal of Chemical Information and Modeling 58 (2), 370-382, 2018 | 7 | 2018 |
Overexpression of LYK4, a lysin motif receptor with non-functional kinase domain, enhances tolerance to Alternaria brassicicola and increases trichome density in Brassica juncea A De, A Maity, M Mazumder, B Mondal, A Mukherjee, S Ghosh, P Ray, ... Plant Science 309, 110953, 2021 | 5 | 2021 |
C-terminal tail insertion of Bcl-x L in membrane occurs via partial unfolding and refolding cycle associating microsolvation A Maity, S Sinha, D Ganguly, SG Dastidar Physical Chemistry Chemical Physics 18 (34), 24095-24105, 2016 | 5 | 2016 |
Structure and Orientation of Water and Choline Chloride Molecules Around a Methane Hydrophobe: A Computer Simulation Study P Nanavare, AR Choudhury, S Sarkar, A Maity, R Chakrabarti ChemPhysChem, 2022 | 4 | 2022 |
Phosphorylation of leghemoglobin at S45 is most effective to disrupt the molecular environment of its oxygen binding pocket K Bhar, A Maity, A Ghosh, T Das, SG Dastidar, A Siddhanta The Protein Journal 34, 158-167, 2015 | 4 | 2015 |
Distinct mode of membrane interaction and disintegration by diverse class of antimicrobial peptides N Agadi, A Maity, AK Jha, R Chakrabarti, A Kumar Biochimica et Biophysica Acta (BBA)-Biomembranes 1864 (12), 184047, 2022 | 3 | 2022 |
Dissecting the thermodynamic contributions of the charged residues in the membrane anchoring of Bcl-xl C-terminal domain A Maity, S Sinha, SG Dastidar Chemistry and physics of lipids 218, 112-124, 2019 | 2 | 2019 |
Reprogramming of glucose metabolism via PFKFB4 is critical in FGF16-driven invasion of breast cancer cells S Kar, N Maji, K Sen, S Roy, A Maity, S Ghosh Dastidar, S Nath, G Basu, ... Bioscience Reports 43 (8), BSR20230677, 2023 | 1 | 2023 |