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John Parkhill
ORCID
Publication Activity (10 Years)
Years Active: 2018-2018
Publications (10 Years): 2
Top Topics
Density Functional Theory
Monte Carlo
Neural Network
Drug Discovery
Top Venues
Chemical science
The Journal of chemical physics
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This page only lists publications with an associated author ORCID identifier.
Publications
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Kun Yao
,
John E Herr
,
David W Toth
,
Ryker Mckintyre
,
John Parkhill
The TensorMol-0.1 model chemistry: a neural network augmented with long-range physics.
Chemical science
9 (8) (2018)
John E Herr
,
Kun Yao
,
Ryker McIntyre
,
David W Toth
,
John Parkhill
Metadynamics for training neural network model chemistries: A competitive assessment.
The Journal of chemical physics
148 (24) (2018)