João M Damas

Publication Activity (10 Years)

Years Active: 2017-2019
Publications (10 Years): 2

Top Topics

Machine Learning

Molecular Dynamics

Top Venues

Journal of chemical information and modeling

Journal of chemical theory and computation

This page only lists publications with an associated author ORCID identifier.

Publications

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. Journal of chemical information and modeling 59 (8) (2019)
Stefan Doerr, Toni Giorgino, Gerard Martínez-Rosell, João M Damas, Gianni De Fabritiis
High-Throughput Automated Preparation and Simulation of Membrane Proteins with HTMD. Journal of chemical theory and computation 13 (9) (2017)