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Pull requests: OpenFreeEnergy/cinnabar

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#125 opened Oct 29, 2024 by PabloNA97 Loading…
Add fraction best ligands metric
#122 opened Jun 5, 2024 by matthewtwarren Loading…
3 of 5 tasks
[WIP]: starting implementing classification metrics.
#121 opened May 16, 2024 by RiesBen Loading…
5 tasks
[WIP] Issue 109 base estimator class
#115 opened Dec 11, 2023 by richardjgowers Loading…
3 tasks
Add functions to calculate cycle closure
#107 opened Nov 6, 2023 by hannahbaumann Loading…
3 tasks
Adding r2max function
#19 opened Sep 4, 2020 by hannahbrucemacdonald Loading…
1 task
ProTip! What’s not been updated in a month: updated:<2024-10-24.