Timir Hajari
Timir Hajari
City College, Kolkata
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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
742015
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
672015
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
192012
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), 04B607_1, 2015
142015
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
122014
Water structure around hydrophobic amino acid side chain analogs using different water models
T Hajari, S Bandyopadhyay
The Journal of chemical physics 146 (22), 225104, 2017
112017
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
82014
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
22017
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
12016
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 (1), 327-332, 2012
12012
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
2019
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 1–12