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 | 72 | 2017 |
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 | 17 | 2017 |
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 | 9 | 2020 |
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 | 5 | 2021 |
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 | 5 | 2021 |
A thermodynamic view of dynamic allostery in a PDZ domain protein A Kumawat, S Chakrabarty Biophysical Journal 116 (3), 163a, 2019 | 1 | 2019 |
Molecular thermodynamic view of bimolecular signaling: allostery and protein-protein interaction A Kumawat CSIR-National Chemical Laboratory, 2020 | | 2020 |