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choderalab / modelforge

Infrastructure to implement and train NNPs
https://modelforge.readthedocs.io/en/latest/
MIT License
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Shuffle by record rather than conformer #42

Closed ArnNag closed 8 months ago

ArnNag commented 8 months ago

Description

Address #39

Status

codecov-commenter commented 8 months ago

Codecov Report

Merging #42 (00369db) into main (a2b2575) will decrease coverage by 0.11%. The diff coverage is 87.93%.

Additional details and impacted files