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Add manually curated transformation network #96

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ijpulidos opened this issue Aug 8, 2023 · 0 comments
Open

Add manually curated transformation network #96

ijpulidos opened this issue Aug 8, 2023 · 0 comments
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@ijpulidos
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Some users have manually curated transformation networks that give very good results, we probably want to add these to the edges for the systems that they were created for, such that we can have more ways of benchmarking and discarding factors when doing the FECs.

Edges are in https://github.com/kntkb/protein-ligand-benchmark-custom/

@ijpulidos ijpulidos added this to the Release 0.3.0 milestone Aug 8, 2023
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