Arghya Chakravorty
8PUBLICATIONS
7CO-AUTHORS
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Publications (8)
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|May 08, 2024
Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules.Arghya Chakravorty, Azam Hussain, Luis F Cervantes
|Jun 02, 2023
pyCHARMM: Embedding CHARMM Functionality in a Python Framework.Joshua Buckner, Xiaorong Liu, Arghya Chakravorty
|Sep 29, 2022
Free Gangliosides Can Alter Amyloid-β Aggregation.Arghya Chakravorty, Samuel D McCalpin, Bikash R Sahoo
|Sep 21, 2020
Entropy of Proteins Using Multiscale Cell Correlation.Arghya Chakravorty, Jonathan Higham, Richard H Henchman
|Mar 11, 2020
Capturing the Effects of Explicit Waters in Implicit Electrostatics Modeling: Qualitative Justification of Gaussian-Based Dielectric Models in DelPhi.Arghya Chakravorty, Shailesh Panday, Swagata Pahari
|Jan 31, 2019
A grid-based algorithm in conjunction with a gaussian-based model of atoms for describing molecular geometry.Arghya Chakravorty, Emilio Gallicchio, Emil Alexov
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