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Fix hydrogen handling in scaffolds with explicit attachment points (#70) #149

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Fix hydrogen handling in scaffolds with explicit attachment points (#70)

Fix hydrogen handling in scaffolds with explicit attachment points (#70) #149

Triggered via push December 18, 2023 12:09
@kmaziarzkmaziarz
pushed e7e9e38
main
Status Success
Total duration 7m 17s
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ci.yml

on: push
Matrix: build
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21 warnings
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
Mamba support is still experimental and can result in differently solved environments!
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.9.16, tf 2.9.1, rdkit 2022.09.1
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
Mamba support is still experimental and can result in differently solved environments!
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.10, tf 2.9.*, rdkit latest
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
Mamba support is still experimental and can result in differently solved environments!
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header
python 3.8.16, tf 2.6.2, rdkit 2021.09.1
warning libmamba Could not parse mod/etag header