Arghya Chakravorty
Orcid: 0000-0002-4467-1135
According to our database1,
Arghya Chakravorty
authored at least 12 papers
between 2016 and 2025.
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Collaborative distances:
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Bibliography
2025
On delivering polar solvation free energy of proteins from energy minimized structures using a regularized super-Gaussian Poisson-Boltzmann model.
J. Comput. Chem., 2025
2024
Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules.
J. Chem. Inf. Model., 2024
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