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Konnektor Integration to OpenFE #17

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2 of 4 tasks

RiesBen opened this issue Feb 20, 2024 · 0 comments

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enhancement Konnektor

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RiesBen commented Feb 20, 2024 •

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Todo:

make Konnektor importable into Openfe
replace old ligand network planners.
make Konnektor Options accessible from CLI
test equality

RiesBen added the enhancement label

RiesBen added the Konnektor label

RiesBen changed the title ~~Cli Integrations~~ Konnektor Integration to OpenFE

RiesBen linked a pull request

that will close this issue

Konnektor integration OpenFreeEnergy/openfe#927

Open

9 tasks

RiesBen removed a link to a pull request

Konnektor integration OpenFreeEnergy/openfe#927

Open

9 tasks

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