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nlesc-nano
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nano-CAT
A collection of tools for the analysis of nanocrystals.
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Added the invert_idx parameter
#47
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BvB93
closed
4 years ago
BvB93
commented
4 years ago
If
True
invert
ligand_idx
,
i.e.
all atoms specified therein are now treated as constants and the rest as variables, rather than the other way around.
True
invertligand_idx
, i.e. all atoms specified therein are now treated as constants and the rest as variables, rather than the other way around.