Journal Publications

Determination of the Reaction Coordinate for a Key Conformational Fluctuation in Human Carbonic Anhydrase II
Authors: Sanjib Paul and Srabani Taraphder
Journal: Journal of Physical Chemistry B, 119 (34), 11403 (2015)   Year: 2015   Posted: 22 Dec 2018
Free energies of proton transfer by polar amino acid sidechain analogues anchored to the outer wall of single walled carbon nanotubes
Authors: T. G. Abi and Srabani Taraphder
Journal: Computational and Theoretical Chemistry, 1027, 19-25 (2014)   Year: 2014   Posted: 22 Dec 2018
Structure and dynamics of water inside endohedrally functionalized carbon nanotubes
Authors: Sanjib Paul, T. G. Abi and Srabani Taraphder
Journal: Journal of Chemical Physics, 140, 184511 (2014)   Year: 2014   Posted: 22 Dec 2018
Proton Affinity of Polar Amino Acid Sidechain Analogues Anchored to the Outer Wall of Single Walled Carbon Nanotubes
Authors: T. G. Abi, Tarak Karmakar and Srabani Taraphder
Journal: Computational & Theoretical Chemistry, 1010, 53-66 (2013)   Year: 2013   Posted: 22 Dec 2018
Modeling the Structure and Proton Transfer Pathways of the Mutant His-107-Tyr of Human Carbonic Anhydrase II
Authors: Puspita Halder and Srabani Taraphder
Journal: J. Molecular Modeling, 19, 289-198 (2013)   Year: 2013   Posted: 22 Dec 2018
Understanding proton affinity of tyrosine sidechain in hydrophobic confinement
Authors: T.G. Abi, T. Karmakar and S. Taraphder
Journal: Journal of Chemical Science, 124, 59-63 (2012)   Year: 2012   Posted: 22 Dec 2018
Proton Transfer Reactions in Carbon Nanotubes Endohedrally Functionalized with Selected Polar Amino Acid Sidechains
Authors: T. G. Abi and Srabani Taraphder
Journal: Chemical Physics, 405, 107-116 (2012)   Year: 2012   Posted: 22 Dec 2018
Chemical Rescue of Enzymes: Proton Transfer in Mutants of Human Carbonic Anhydrase II
Authors: C. Mark Maupin, Norberto Castillo, Srabani Taraphder, Chingkuang Tu, Robert McKenna, David N. Silverman and Gregory A. Voth
Journal: Journal of the American Chemical Society, 133, 6223-6234 (2011)   Year: 2011   Posted: 22 Dec 2018
Role of Protein Motions on Proton Transfer Pathways in Human Carbonic Anhydrase II
Authors: Arijit Roy and Srabani Taraphder
Journal: BBA Proteins & Proteomics, Special issue on Carbonic Anhydrase and Superoxide Dismutase, 1804, 351-361 (2010)   Year: 2010   Posted: 22 Dec 2018
Free Energies of Supercritical Solvation from Molecular Dynamics Simulation and Integral Equation Studies
Authors: Tapas Ranjan Kunor and Srabani Taraphder
Journal: Physica A, 388, 1491 (2009)   Year: 2009   Posted: 22 Dec 2018
A Theoretical Study on the Detection of Proton Transfer Pathways in Some Mutants of Human Carbonic Anhydrase II
Authors: Arijit Roy and Srabani Taraphder
Journal: J. Phys. Chem. B, 112, 13597 (2008)   Year: 2008   Posted: 22 Dec 2018
Identification of Proton-Transfer Pathways in Human Carbonic Anhydrase II
Authors: Arijit Roy and Srabani Taraphder
Journal: J. Phys. Chem. B, 111, 10563 (2007)   Year: 2007   Posted: 22 Dec 2018
Effect of Electrostatic Interactions on the Formation of Proton transfer pathways in Human Carbonic Anhydrase II
Authors: Arijit Roy and Srabani Taraphder
Journal: J. Chem. Sci. (Special Issue), 119, 545 (2007)   Year: 2007   Posted: 22 Dec 2018
Equilibrium Correlations and Thermodynamics in Low Density Supercritical Lennard-Jones Fluids
Authors: Tapas R. Kunor and Srabani Taraphder
Journal: Physica A, 383, 401 (2007)   Year: 2007   Posted: 22 Dec 2018
Bridge Functions near the Liquid-vapor Coexistence Curve in Binary Lennard-Jones Mixtures
Authors: Tapas R. Kunor and Srabani Taraphder
Journal: Phys. Rev. E, 74, 011210 (2006)   Year: 2006   Posted: 22 Dec 2018
Proton Transfer Pathways in the Mutant His-64–Ala of Human Carbonic Anhydrase II
Authors: Arijit Roy and Srabani Taraphder
Journal: Biopolymers, 82, 623 (2006)   Year: 2006   Posted: 22 Dec 2018
Fluid Phase Diagrams of Binary Mixtures from Constant Pressure Integral Equations
Authors: Giorgio Pastore, Robert Santin, Srabani Taraphder and F. Colonna
Journal: J. Chem. Phys., 122 (2005) 181104   Year: 2005   Posted: 22 Dec 2018
Molecular Dynamics Study of the Density and Temperature Dependence of Bridge Functions in Normal and Supercritical Lennard-Jones Fluids
Authors: Tapas R. Kunor and Srabani Taraphder
Journal: Phys. Rev. E, 72, 031201 (2005)   Year: 2005   Posted: 22 Dec 2018
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