Suman Chakrabarty, PhD

Affiliations: 
2012-2017 CSIR-National Chemical Laboratory, Pune, India 
 2017-2018 NISER Bhubaneswar 
 2018- S. N. Bose National Centre for Basic Sciences 
Area:
Theoretical/Computational chemistry, computational modeling of complex systems
Website:
http://www.namusite.com
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Publications

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Kumawat A, Chakrabarty S. (2020) Protonation-Induced Dynamic Allostery in PDZ Domain: Evidence of Perturbation-Independent Universal Response Network. The Journal of Physical Chemistry Letters. 9026-9031
Choudhary N, Hande VR, Roy S, et al. (2018) Effect of SDS Surfactant on Methane Hydrate Formation: A Molecular Dynamics Study. The Journal of Physical Chemistry. B
Sharma P, Chakrabarty S, Roy S, et al. (2018) Molecular View of CO Capture by Polyethylenimine: Role of Structural and Dynamical Heterogeneity. Langmuir : the Acs Journal of Surfaces and Colloids
Kumawat A, Chakrabarty S. (2017) Hidden electrostatic basis of dynamic allostery in a PDZ domain. Proceedings of the National Academy of Sciences of the United States of America
Kumawat A, Chakrabarty S, Kulkarni K. (2017) Nucleotide Dependent Switching in Rho GTPase: Conformational Heterogeneity and Competing Molecular Interactions. Scientific Reports. 7: 45829
Chamachi NG, Chakrabarty S. (2017) Temperature Induced Misfolding in Prion Protein: Evidences of Multiple Partially Disordered States Stabilized by Non-native Hydrogen Bonds. Biochemistry
Singh RK, Chamachi NG, Chakrabarty S, et al. (2016) Mechanism of Unfolding of Human Prion Protein. The Journal of Physical Chemistry. B
Nandi UK, Banerjee A, Chakrabarty S, et al. (2016) Composition dependence of the glass forming ability in binary mixtures: The role of demixing entropy. The Journal of Chemical Physics. 145: 034503
Hande VR, Chakrabarty S. (2016) Exploration of the presence of bulk-like water in AOT reverse micelles and water-in-oil nanodroplets: the role of charged interfaces, confinement size and properties of water. Physical Chemistry Chemical Physics : Pccp
Chamachi NG, Chakrabarty S. (2016) Replica Exchange Molecular Dynamics Study of Dimerization in Prion Protein: Multiple Modes of Interaction and Stabilization. The Journal of Physical Chemistry. B
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