v1.1.0 Search API: Retain nesting of queries, Data API: add querying for all structures #51
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Co-authored-by: Dennis Piehl <[email protected]>
Search API: Retain nesting of queries, Data API: add querying for all structures
piehld
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Mar 12, 2025
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Thank you again @ivana-truong! This all looks excellent!
Linking to the original PR to staging here for reference: #50
piehld
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Search API
__and__/__or__method ofSearchQueryand addedgroupmethod in response to Issue in grouped attribute search #49. Now building queries withgroupfunction will cause the group to be preserved while constructing the rest of the queryData API
const.py/data.__init__.py. This can be passed into theinput_idsparameter to make a query for all structures. Currently supportsentriesandchem_compsinput_typesprogress_barparameter to.exec. If set toTrue, there will be a progress bar for the executing query.batch_sizeparameter to.exec. Defaults to 5,000.Misc