Protein Hydration Dynamics: Much Ado about Nothing? S Mondal, S Mukherjee, B Bagchi The Journal of Physical Chemistry Letters 8 (19), 4878-4882, 2017 | 55 | 2017 |
What gives an insulin hexamer its unique shape and stability? Role of ten confined water molecules S Mukherjee, S Mondal, AA Deshmukh, B Gopal, B Bagchi The Journal of Physical Chemistry B 122 (5), 1631-1637, 2018 | 53 | 2018 |
Distinguishing dynamical features of water inside protein hydration layer: Distribution reveals what is hidden behind the average S Mukherjee, S Mondal, B Bagchi The Journal of Chemical Physics 147 (2), 2017 | 53 | 2017 |
Origin of diverse time scales in the protein hydration layer solvation dynamics: A simulation study S Mondal, S Mukherjee, B Bagchi The Journal of chemical physics 147 (15), 2017 | 47 | 2017 |
Unique features of metformin: a combined experimental, theoretical, and simulation study of its structure, dynamics, and interaction energetics with DNA grooves S Mondal, RN Samajdar, S Mukherjee, AJ Bhattacharyya, B Bagchi The Journal of Physical Chemistry B 122 (8), 2227-2242, 2018 | 44 | 2018 |
Mechanism of solvent control of protein dynamics S Mukherjee, S Mondal, B Bagchi Physical review letters 122 (5), 058101, 2019 | 41 | 2019 |
Decomposition of total solvation energy into core, side-chains and water contributions: Role of cross correlations and protein conformational fluctuations in dynamics of … S Mondal, S Mukherjee, B Bagchi Chemical Physics Letters 683, 29-37, 2017 | 26* | 2017 |
DNA solvation dynamics S Mukherjee, S Mondal, S Acharya, B Bagchi The Journal of Physical Chemistry B 122 (49), 11743-11761, 2018 | 24 | 2018 |
A redox-active 2-D covalent organic framework as a cathode in an aqueous mixed-ion electrolyte Zn-ion battery: experimental and theoretical investigations A Venkatesha, R Gomes, AS Nair, S Mukherjee, B Bagchi, ... ACS Sustainable Chemistry & Engineering 10 (19), 6205-6216, 2022 | 23 | 2022 |
Mathematical modeling and cellular automata simulation of infectious disease dynamics: Applications to the understanding of herd immunity S Mondal, S Mukherjee, B Bagchi The Journal of chemical physics 153 (11), 2020 | 21 | 2020 |
Thermodynamic forces from protein and water govern condensate formation of an intrinsically disordered protein domain S Mukherjee, LV Schäfer Nature Communications 14 (5892), 2023 | 18 | 2023 |
Entropic Origin of the Attenuated Width of the Ice–Water Interface S Mukherjee, B Bagchi The Journal of Physical Chemistry C 124 (13), 7334-7340, 2020 | 18 | 2020 |
Rate of Insulin Dimer Dissociation: Interplay between Memory Effects and Higher Dimensionality S Acharya, S Mondal, S Mukherjee, B Bagchi The Journal of Physical Chemistry B, 2021 | 17 | 2021 |
Tug-of-war between internal and external frictions and viscosity dependence of rate in biological reactions S Mukherjee, S Mondal, S Acharya, B Bagchi Physical Review Letters, 2022 | 16 | 2022 |
Structural Stability of Insulin Oligomers and Protein Association–Dissociation Processes: Free Energy Landscape and Universal Role of Water S Mukherjee, S Acharya, S Mondal, P Banerjee, B Bagchi The Journal of Physical Chemistry B, 2021 | 16 | 2021 |
Spatially Resolved Hydration Thermodynamics in Biomolecular Systems S Mukherjee, LV Schäfer The Journal of Physical Chemistry B, 2022 | 14 | 2022 |
Destabilization of Insulin Hexamer in Water–Ethanol Binary Mixture S Mukherjee, AA Deshmukh, S Mondal, B Gopal, B Bagchi The Journal of Physical Chemistry B 123 (49), 10365-10375, 2019 | 10 | 2019 |
Dynamical theory and cellular automata simulations of pandemic spread: Understanding different temporal patterns of infections S Mukherjee, S Mondal, B Bagchi arXiv preprint arXiv:2004.14787, 2020 | 8 | 2020 |
Unfolding of Dynamical Events in the Early Stage of Insulin Dimer Dissociation S Mondal, S Mukherjee, S Acharya, B Bagchi The Journal of Physical Chemistry B, 2021 | 6 | 2021 |
Theoretical analyses of pressure induced glass transition in water: Signatures of surprising diffusion-entropy scaling across the transition S Mukherjee, B Bagchi Molecular Physics 119 (19-20), e1930222, 2021 | 4 | 2021 |