theochem / Selector

Methods for selecting diverse (molecular) database.
https://selector.qcdevs.org
GNU General Public License v3.0
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dissimilarity.py missing from methods folder #208

Closed FanwangM closed 1 week ago

FanwangM commented 1 month ago

Discussed in https://github.com/theochem/Selector/discussions/207

Originally posted by **JackyZzZz** May 15, 2024 I noticed that we need to import ```dissimilarity.py``` from ```methods``` in the ```Running Dissimilarity Algorithms``` example in the documentation. However, it seems like this file is missing from the methods folder. P.S: I think it is renamed to distance.py, so we should probably update the documentation. ## Add-on: - the first parameter of ```select``` function in base.py is ```X```, not ```arr``` in the documentation

I will do a cleaning up before more actual code changes.

FanwangM commented 1 week ago

This is suppressd by https://github.com/theochem/Selector/issues/216.