Arghya Chakravorty
Orcid: 0000-0002-4467-1135
According to our database1,
Arghya Chakravorty
authored at least 10 papers
between 2016 and 2021.
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Collaborative distances:
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Bibliography
2021
Energy-entropy method using multiscale cell correlation to calculate binding free energies in the SAMPL8 host-guest challenge.
J. Comput. Aided Mol. Des., 2021
2020
Capturing the Effects of Explicit Waters in Implicit Electrostatics Modeling: Qualitative Justification of Gaussian-Based Dielectric Models in DelPhi.
J. Chem. Inf. Model., 2020
2019
A grid-based algorithm in conjunction with a gaussian-based model of atoms for describing molecular geometry.
J. Comput. Chem., 2019
Reproducing ensemble averaged electrostatics with Super-Gaussian-based smooth dielectric function: application to electrostatic component of binding energy of protein complexes.
Commun. Inf. Syst., 2019
2017
DelPhiForce, a tool for electrostatic force calculations: Applications to macromolecular binding.
J. Comput. Chem., 2017
J. Comput. Chem., 2017
DelPhiForce web server: electrostatic forces and energy calculations and visualization.
Bioinform., 2017
2016
Electrostatic component of binding energy: Interpreting predictions from poisson-boltzmann equation and modeling protocols.
J. Comput. Chem., 2016