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Add cro volume
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aalexmmaldonado committed Dec 8, 2024
1 parent 7077a87 commit 690f618
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1 change: 1 addition & 0 deletions pixi.toml
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Expand Up @@ -44,6 +44,7 @@ xgboost = ">=2.1.1"
ambertools = ">=23.6,<24"
xtb = ">=6.7.1,<7"
openbabel = ">=3.1.1,<4"
pandas = ">=2.2.3,<3"

[feature.dev.dependencies]
black = ">=23.10.0"
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2 changes: 2 additions & 0 deletions study/figures/a-cro/a003-cro66_vol/.pages
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nav:
- index.md
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