Shampa Raghunathan

5PUBLICATIONS
6CO-AUTHORS
Chemical thermodynamics and energeticsBiomolecular modelling and designCancer geneticsTheoretical quantum chemistry
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (5)

|Dec 30, 2025
Machine-learned potentials for solvation modeling.

Roopshree Banchode, Surajit Das, Shampa Raghunathan

|May 14, 2025
Graph Neural Network for 3-Dimensional Structures Including Dihedral Angles for Molecular Property Prediction.

Sri Abhirath Reddy Sangala, Shampa Raghunathan

|Jun 02, 2021
Multiscale Modeling of Wobble to Watson-Crick-Like Guanine-Uracil Tautomerization Pathways in RNA.

Shreya Chandorkar, Shampa Raghunathan, Tanashree Jaganade

|Nov 27, 2020
Polarizable Multipolar Molecular Dynamics Using Distributed Point Charges.

Mike Devereux, Marco Pezzella, Shampa Raghunathan

Pageof 1