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Physical Chemistry

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Theoretical and Computational Chemistry

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Sompriya Chatterjee

3 results in Authors: Sompriya Chatterjee

Theoretical and Computational Chemistry

Data-driven enhanced sampling of mechanistic pathways

Revanth Elangovan, Sompriya Chatterjee, Dhiman Ray

Version 1 posted 30 June 2025

139

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Theoretical and Computational Chemistry

Acceleration with Interpretability: Surrogate Model Based Collective Variable for Enhanced Sampling

Sompriya Chatterjee, Dhiman Ray

Version 1 posted 27 November 2024

414

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Theoretical and Computational Chemistry

Characterizing RNA Tetramer Conformational Landscape Using Explainable Machine Learning

Sompriya Chatterjee, Dhiman Ray

Version 1 posted 24 April 2025

115

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