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Amit Kumawat
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Year
Hidden electrostatic basis of dynamic allostery in a PDZ domain
A Kumawat, S Chakrabarty
Proceedings of the National Academy of Sciences 114 (29), E5825-E5834, 2017
722017
Nucleotide dependent switching in rho GTPase: conformational heterogeneity and competing molecular interactions
A Kumawat, S Chakrabarty, K Kulkarni
Scientific reports 7 (1), 1-11, 2017
172017
Protonation-induced dynamic allostery in PDZ domain: evidence of perturbation-independent universal response network
A Kumawat, S Chakrabarty
The Journal of Physical Chemistry Letters 11 (21), 9026-9031, 2020
92020
Integrated docking and enhanced sampling-based selection of repurposing drugs for SARS-CoV-2 by targeting host dependent factors
A Kumawat, S Namsani, D Pramanik, S Roy, JK Singh
Journal of Biomolecular Structure and Dynamics, 1-12, 2021
52021
Organoselenium compounds as acetylcholinesterase inhibitors: Evidence and mechanism of mixed inhibition
A Kumawat, S Raheem, F Ali, TA Dar, S Chakrabarty, MA Rizvi
The Journal of Physical Chemistry B 125 (6), 1531-1541, 2021
52021
A thermodynamic view of dynamic allostery in a PDZ domain protein
A Kumawat, S Chakrabarty
Biophysical Journal 116 (3), 163a, 2019
12019
Molecular thermodynamic view of bimolecular signaling: allostery and protein-protein interaction
A Kumawat
CSIR-National Chemical Laboratory, 2020
2020
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Articles 1–7