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Pull requests: openkinome/kinoml

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Pull requests list

[WIP] Change from conda to uv
#141 opened Aug 14, 2025 by mbackenkoehler Loading…
1 task
Create a docker image for kinoml enhancement New feature or request high-priority
#139 opened Aug 14, 2025 by joschka-gross Loading…
@mbackenkoehler
1
Add files via upload
#136 opened Feb 26, 2025 by raquellrios Collaborator Loading…
2
Old featurizer
#111 opened Mar 15, 2022 by schallerdavid Contributor • Draft
1
Old examples
#110 opened Mar 15, 2022 by schallerdavid Contributor • Draft
1
re-add HM functionalities
#75 opened Aug 18, 2021 by AndreaVolkamer Contributor • Draft
2 tasks
2
Dunbrack clusters
#71 opened Aug 17, 2021 by t-kimber Contributor • Draft
1
running notebook with custom loss class for skorch.
#27 opened Aug 20, 2020 by t-kimber Contributor • Draft
2 of 5 tasks
1
Refactor kinmodel set of scripts
#2 opened Sep 16, 2019 by jaimergp Member • Draft
8 tasks
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