view article
Figure 3
Heat of formation (kcal mol−1) computed in DivCon for the structure 1lri after each macro-cycle of the full QM refinement.

Journal logoSTRUCTURAL
BIOLOGY
ISSN: 2059-7983
Volume 70| Part 5| May 2014| Pages 1233-1247
https://doi.org/10.1107/S1399004714002260
Follow Acta Cryst. D
Sign up for e-alerts
E-alerts
Follow Acta Cryst. on Twitter
Twitter
Follow us on facebook
Facebook
Sign up for RSS feeds
RSS