google-deepmind / alphafold3

AlphaFold 3 inference pipeline.
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Residue numbering start specification #74

Open lucajovine opened 3 days ago

lucajovine commented 3 days ago

This is not a bug but rather a request that, however, I am sure everybody will stand by: please add a way to specify in the input json file what is the number of the starting residue of each chain.

As users, we almost always have to do this "by hand" a posteriori, since AlphaFold numbering start defaults to 1 and - in the majority of cases - does not match the one we actually work with. This is a small change that could make things much easier for everybody, so I hope you'll take the suggestion into consideration. Thank you!