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Catalysis

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Saumya Thakur

2 results in Authors: Saumya Thakur

An Unsupervised Machine Learning Workflow for Assigning and Predicting Generality in Asymmetric Catalysis

Isaiah Betinol, Junshan Lai, Saumya Thakur, Jolene Reid

Version 2 posted 14 March 2023

810

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Theoretical and Computational Chemistry

DeepWEST: Deep learning of kinetic models with the Weighted Ensemble Simulation Toolkit for enhanced sampling

Anupam Ojha, Saumya Thakur, Surl-Hee Ahn, Rommie Amaro

Version 3 posted 02 December 2022

793

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