OpenADMET/data-catalogs: v0.2.0
收藏资源简介:
What's Changed Fix/21/fix pdb text by @khuddzu in https://github.com/OpenADMET/data-catalogs/pull/23 Restructure structure catalog and add mmCIF files by @khuddzu in https://github.com/OpenADMET/data-catalogs/pull/26 Add IVIVE scaling for microsomal data by @cynthiaxu04 in https://github.com/OpenADMET/data-catalogs/pull/28 Add Caco-2 and MDCK files by @mariacm12 in https://github.com/OpenADMET/data-catalogs/pull/29 Reindex existing parquet files in activities by @khuddzu in https://github.com/OpenADMET/data-catalogs/pull/30 Add README for structures by @khuddzu in https://github.com/OpenADMET/data-catalogs/pull/32 Add curated datasets for LogD, Caco-2 and PPB by @mariacm12 in https://github.com/OpenADMET/data-catalogs/pull/33 Add updated ChEMBL 37 data curation by @cynthiaxu04 in https://github.com/OpenADMET/data-catalogs/pull/35 New Contributors @mariacm12 made their first contribution in https://github.com/OpenADMET/data-catalogs/pull/29 Full Changelog: https://github.com/OpenADMET/data-catalogs/compare/v0.1.0-alpha...v0.2.0



