J Harry Moore
4PUBLICATIONS
88CO-AUTHORS
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Publications (4)
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|Jan 27, 2026
Computing Solvation Free Energies of Small Molecules with Experimental Accuracy.J Harry Moore, Daniel J Cole, Gábor Csányi
|Nov 13, 2025
A foundation model for atomistic materials chemistry.Ilyes Batatia, Philipp Benner, Yuan Chiang
|May 19, 2025
MACE-OFF: Short-Range Transferable Machine Learning Force Fields for Organic Molecules.Dávid Péter Kovács, J Harry Moore, Nicholas J Browning
|Apr 27, 2023
Automated relative binding free energy calculations from SMILES to ΔΔG.J Harry Moore, Christian Margreitter, Jon Paul Janet
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Frequent Collaborators
3 joint publications
Gábor Csányi
2 joint publications
Dávid Péter Kovács
2 joint publications
Ioan-Bogdan Magdău
1 joint publications
Jon Paul Janet
1 joint publications
Ola Engkvist
1 joint publications
Bert L de Groot
1 joint publications
Vytautas Gapsys
1 joint publications
Joshua T Horton
1 joint publications
Ilyes Batatia
1 joint publications
Philipp Benner
