PyDigger - unearthing stuff about Python


NameVersionSummarydate
mofstructure 0.1.3 A python tool to deconstruct MOFs into building units and compute porosity. The code remove guest from MOFs and all porous systems, compute smiles strings and inchikeys of all building units. 2023-11-28 09:51:23
focus-package 3.0.1 FOCUS package including DLS-76 and KRIBER 2023-01-17 14:13:10
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