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João M. Damas
ORCID
Publication Activity (10 Years)
Years Active: 2014-2019
Publications (10 Years): 1
Top Topics
Machine Learning
Molecular Dynamics Simulations
Multiscale
Pairwise
Top Venues
J. Chem. Inf. Model.
PLoS Comput. Biol.
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Publications
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Raimondas Galvelis
,
Stefan Doerr
,
João M. Damas
,
Matt J. Harvey
,
Gianni De Fabritiis
A Scalable Molecular Force Field Parameterization Method Based on Density Functional Theory and Quantum-Level Machine Learning.
J. Chem. Inf. Model.
59 (8) (2019)
A. Sofia F. Oliveira
,
João M. Damas
,
António M. Baptista
,
Cláudio M. Soares
Oxidases: Molecular Dynamics Simulations Uncover Two Alternative Channels towards the Binuclear Site.
PLoS Comput. Biol.
10 (12) (2014)