Arghya Chakravorty

Loop profile ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 10

Top Venues

Journal of chemical information and modeling

Journal of chemical theory and computation

The journal of physical chemistry letters

Journal of computational chemistry

University of Michigan

Clemson University (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Michigan Sep 03 2019

United States

Postdoctoral fellow :: Department of Chemistry

Clemson University - Aug 08 2019

United States

Graduate Research Assistant :: Department of Physics and Astronomy

Clemson University

United States

Graduate Teaching Assistant :: Department of Physics and Astronomy

Education History

Clemson University

United States

PHD :: Department of Physics and Astronomy

Publications

Arghya Chakravorty, Azam Hussain, Luis F Cervantes, Thanh T Lai, Charles L Brooks Iii
Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules. Journal of chemical information and modeling 64 (10) (2024)
Arghya Chakravorty, Azam Hussain, Luis F Cervantes, Thanh T Lai, Charles L Brooks Iii
Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules. Journal of chemical information and modeling 64 (10) (2024)
Arghya Chakravorty, Azam Hussain, Luis F Cervantes, Thanh T Lai, Charles L Brooks Iii
Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules. Journal of chemical information and modeling (2024)
Joshua Buckner, Xiaorong Liu, Arghya Chakravorty, Yujin Wu, Luis F Cervantes, Thanh T Lai, Charles L Brooks Iii
pyCHARMM: Embedding CHARMM Functionality in a Python Framework. Journal of chemical theory and computation (2023)
Arghya Chakravorty, Samuel D McCalpin, Bikash R Sahoo, Ayyalusamy Ramamoorthy, Charles L Brooks Iii
Free Gangliosides Can Alter Amyloid-β Aggregation. The journal of physical chemistry letters 13 (40) (2022)
Arghya Chakravorty, Jonathan Higham, Richard H Henchman
Entropy of Proteins Using Multiscale Cell Correlation. Journal of chemical information and modeling 60 (11) (2020)
Arghya Chakravorty, Shailesh Panday, Swagata Pahari, Shan Zhao, Emil Alexov
Capturing the Effects of Explicit Waters in Implicit Electrostatics Modeling: Qualitative Justification of Gaussian-Based Dielectric Models in DelPhi. Journal of chemical information and modeling 60 (4) (2020)
Arghya Chakravorty, Emilio Gallicchio, Emil Alexov
A grid-based algorithm in conjunction with a gaussian-based model of atoms for describing molecular geometry. Journal of computational chemistry 40 (12) (2019)
Arghya Chakravorty, Zhe Jia, Lin Li, Shan Zhao, Emil Alexov
Reproducing the Ensemble Average Polar Solvation Energy of a Protein from a Single Structure: Gaussian-Based Smooth Dielectric Function for Macromolecular Modeling. Journal of chemical theory and computation 14 (2) (2018)
Arghya Chakravorty, Zhe Jia, Lin Li, Emil Alexov
A New DelPhi Feature for Modeling Electrostatic Potential around Proteins: Role of Bound Ions and Implications for Zeta-Potential. Langmuir : the ACS journal of surfaces and colloids 33 (9) (2017)

Arghya Chakravorty.css-eqlu8i{font-size:small;padding-left:4px;}

Publication Activity (10 Years)

Top Topics

Top Venues

Arghya Chakravorty