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msg-byu / enumlib

Derivative structure enumeration library
MIT License
59 stars 34 forks source link

Modified the format of the 'conf_id' tag in MTP-style config files. T… #105

Closed glwhart closed 3 years ago

glwhart commented 3 years ago

…he tag now includes the struct_enum.in title, ordinal number in the list, and the size of the symmetry group of the structure.