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Bienchen
AlphaPulldown-ModelCIF-Conversion
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bbbbed16
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bbbbed16
authored
1 year ago
by
Bienchen
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Notes for scores
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convert_to_modelcif.py
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...
...
@@ -117,7 +117,14 @@ def _store_as_modelcif(
name
=
"
ToDo: Model <N> (ranked #<M>)
"
,
)
# ToDO: check data_json["model_group_name"] at Tara's
# process scores
# ToDo: Get scores, but where are they stored? For other AF2 related
# projects, there are JSON or Pickle files with all AF2 scores
# system.repositories.append(
# model.add_scores(data_json, system.id, mdl_name, add_files)
# )
# ToDo: check data_json["model_group_name"] at Tara's
system
.
model_groups
.
append
(
modelcif
.
model
.
ModelGroup
([
model
]))
# ToDo: get protocol steps together
...
...
@@ -360,6 +367,7 @@ if __name__ == "__main__":
# 'data_', '_entry', maybe have a user-defined JSON document with things
# like that, including author names?
# ToDo: where to store which model was chosen? Should be in Tara's models.
# ToDo: make sure all functions come with types
# LocalWords: ToDo AlphaPulldown PAEs dir struct coevolution MSA py modeling
# LocalWords: multimer sif Jupyter
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