Standards-based curation of a decade-old digital repository dataset of molecular information.

Harvey, Matthew J; Mason, Nicholas J; McLean, Andrew; Murray-Rust, Peter; Rzepa, Henry S; Stewart, James J P.

Afiliação

Harvey MJ; High Performance Computing Service, Imperial College London, London, SW7 2AZ UK.
Mason NJ; Department of Chemistry, Imperial College London, South Kensington Campus, London, SW7 2AZ UK.
McLean A; High Performance Computing Service, Imperial College London, London, SW7 2AZ UK.
Murray-Rust P; Department of Chemistry, Centre for Molecular Informatics, Lensfield Road, Cambridge, CB2 1EW UK.
Rzepa HS; Department of Chemistry, Imperial College London, South Kensington Campus, London, SW7 2AZ UK.
Stewart JJ; Stewart Computational Chemistry, 15210 Paddington Circle, Colorado Springs, CO 80921 USA.

J Cheminform ; 7: 43, 2015.

Article em En | MEDLINE | ID: mdl-26322133