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John Gounley

2 results in Authors: John Gounley

Theoretical and Computational Chemistry

Adaptive Language Model Training for Molecular Design

Andrew Blanchard, Debsindhu Bhowmik, Zachary Fox, John Gounley, Jens Glaser, Belinda S Akpa, Stephan Irle

Version 3 posted 12 April 2023

650

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Chemical Engineering and Industrial Chemistry

Computational Workflow for Accelerated Molecular Design Using Quantum Chemical Simulations and Deep Learning Models

Andrew Blanchard, Pei Zhang, Debsindhu Bhowmik, Kshitij Mehta, John Gounley, Samuel Temple Reeve, Stephan Irle, Massimiliano Lupo Pasini

Version 2 posted 17 August 2022

510

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