ABSTRACT

Development of an informatics infrastructure for data exchange of biomolecular simulations: Architecture, data models and ontology.

Thibault JC, Roe DR, Eilbeck K, Cheatham Iii TE, Facelli JC

SAR QSAR Environ Res. 2015;26(7-9):577-93. doi: 10.1080/1062936X.2015.1076515. Epub 2015 Sep 21

PMID: 26387907