Supercell program: a combinatorial structure-generation approach for the local-level modeling of atomic substitutions and partial occupancies in crystals
Okhotnikov, Kirill, Charpentier, Thibault, Cadars, SylvianVolume:
8
Language:
english
Journal:
Journal of Cheminformatics
DOI:
10.1186/s13321-016-0129-3
Date:
December, 2016
File:
PDF, 2.22 MB
english, 2016