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Physical Chemistry Chemical Physics : PCCP|June 7, 2018
Synergistic host-guest hydrophobic and hydrogen bonding interactions in the complexation between endo-functionalized molecular tube and strongly hydrophilic guest molecules in aqueous solutionRabindranath Paul, Sandip PaulThe Journal of Chemical Physics|March 27, 2012
The effect of pressure on the hydration structure around hydrophobic solute: a molecular dynamics simulation studyRahul Sarma, Sandip PaulJournal of Chemical Theory and Computation|December 4, 2015
Hydrogen Bond Properties and Dynamics of Liquid-Vapor Interfaces of Aqueous Methanol SolutionsSandip Paul, Amalendu ChandraPlos One|January 12, 2018
Exploring the binding sites and binding mechanism for hydrotrope encapsulated griseofulvin drug on γ-tubulin proteinShubhadip Das, Sandip PaulThe Journal of Physical Chemistry. B|March 24, 2026
Exploring Structural Perturbations Caused by Cancer-Related Mutations in Pyruvate Kinase M2: A Comparison with the Wild-Type EnzymeAnandita Mitra, Sandip PaulThe Journal of Physical Chemistry. B|April 3, 2019
Inhibitory Effect of Choline- O-sulfate on Aβ16-22 Peptide Aggregation: A Molecular Dynamics Simulation StudySrijita Paul, Sandip PaulThe Journal of Physical Chemistry. B|February 10, 2026
Markov State Models Reveal How hLL-3717-29 Tetramers Relax from a Disordered State to a Cross-α Amyloid GeometryAritra Mitra, Sandip PaulInternational Journal of Biological Macromolecules|October 12, 2018
Conformational deviation of Thrombin binding G-quadruplex aptamer (TBA) in presence of divalent cation Sr2+: A classical molecular dynamics simulation studySaikat Pal, Sandip PaulPhysical Chemistry Chemical Physics : PCCP|September 19, 2024
Salt-bridge mediated conformational dynamics in the figure-of-eight knotted ketol acid reductoisomerase (KARI)Sanjib Thakuria, Sandip PaulPageof 17