Bringing the MMFF force field to the RDKit: implementation and validation
Crossref DOI link: https://doi.org/10.1186/s13321-014-0037-3
Published Online: 2014-07-12
Published Print: 2014-12
Update policy: https://doi.org/10.1007/springer_crossmark_policy
Tosco, Paolo
Stiefl, Nikolaus
Landrum, Gregory
Text and Data Mining valid from 2014-07-12
Article History
Received: 12 March 2014
Accepted: 30 June 2014
First Online: 12 July 2014