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Timir Hajari
Timir Hajari
City College, Kolkata
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引用先
引用先
Mechanism of polymer collapse in miscible good solvents
F Rodríguez-Ropero, T Hajari, NFA van der Vegt
The Journal of Physical Chemistry B 119 (51), 15780-15788, 2015
1082015
Mutual Exclusion of Urea and Trimethylamine N-Oxide from Amino Acids in Mixed Solvent Environment
P Ganguly, T Hajari, JE Shea, NFA van der Vegt
The journal of physical chemistry letters 6 (4), 581-585, 2015
872015
Enthalpy–entropy of cation association with the acetate anion in water
T Hajari, P Ganguly, NFA van der Vegt
Journal of chemical theory and computation 8 (10), 3804-3809, 2012
262012
Solvation thermodynamics of amino acid side chains on a short peptide backbone
T Hajari, NFA van der Vegt
The Journal of Chemical Physics 142 (14), 2015
242015
Molecular simulation study on hofmeister cations and the aqueous solubility of benzene
P Ganguly, T Hajari, NFA van der Vegt
The Journal of Physical Chemistry B 118 (20), 5331-5339, 2014
202014
Water structure around hydrophobic amino acid side chain analogs using different water models
T Hajari, S Bandyopadhyay
The Journal of Chemical Physics 146 (22), 2017
192017
Peptide backbone effect on hydration free energies of amino acid side chains
T Hajari, NFA van der Vegt
The Journal of Physical Chemistry B 118 (46), 13162-13168, 2014
112014
Solvation structures of sodium halides in dimethyl sulfoxide (DMSO)–methanol (MeOH) mixtures
MK Dixit, T Hajari, BL Tembe
Molecular Simulation 43 (3), 154-168, 2017
82017
The effect of urea and taurine osmolytes on hydrophobic association and solvation of methane and neopentane molecules
MK Dixit, T Hajari, BL Tembe
Journal of Molecular Liquids 223, 660-671, 2016
72016
Hydrophobic association and solvation of neopentane in urea, TMAO and urea–TMAO solutions
T Hajari, M Dixit, HOS Yadav
Physical Chemistry Chemical Physics 24 (11), 6941-6957, 2022
42022
Ion pairing and preferential solvation of butylmethylimidazolium chloride ion pair in water-ethanol mixtures by using molecular dynamics simulations
MD Meti, M Dixit, T Hajari, BL Tembe
Chemical Physics Letters 720, 107-112, 2019
42019
Impact of an Ionic Liquid on Amino Acid Side Chains: A Perspective from Molecular Simulation Studies
KP Ghanta, S Mondal, T Hajari, S Bandyopadhyay
Journal of Chemical Information and Modeling 63 (3), 959-972, 2023
22023
Potentials of mean force for the exo and endo solvolysis of 2-norbornyl chloride in water and DMSO: A constrained molecular dynamics study#
SC Tiwari, T Hajari, A Sharma, BL Tembe
Journal of Chemical Sciences 124, 327-332, 2012
12012
Ionic Pairing and Selective Solvation of Butylmethylimidazolium Chloride Ion Pairs in DMSO–Water Mixtures: A Comprehensive Examination via Molecular Dynamics Simulations and …
M Dixit, T Hajari, MD Meti, S Srivastava, A Srivastava, J Daniel
The Journal of Physical Chemistry B, 2024
2024
Ionic Pairing and Selective Solvation of Butylmethylimidazolium Chloride Ion Pair in DMSO-Water Mixtures: A Comprehensive Examination via Molecular Dynamics Simulations and …
MD Meti, S Srivastava, A Srivastava, T Hajari, M Dixit
2023
Molecular simulations of Hofmeister ion pairing and solvation of protein building blocks in aqueous interfacial environments
T Hajari
TU Darmstadt, 2015
2015
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論文 1–16