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Department of Chemistry

 

Publications

Reproducing Quantum Probability Distributions at the Speed of Classical Dynamics: A New Approach for Developing Force-Field Functors
V Sundar, D Gelbwaser-Klimovsky, A Aspuru-Guzik
– Journal of Physical Chemistry Letters
(2018)
9,
1721
Debiasing Algorithms for Protein Ligand Binding Data do not Improve Generalisation
V Sundar, L Colwell

Telephone number

01223 336471 (shared)