46 Commits

Author	SHA1	Message	Date
Alexander Rose	44610b8b1a	update cif schema	2024-06-12 21:50:49 -07:00
dsehnal	76ee97301b	atom_site.pdbx_label_index support	2022-02-07 17:44:03 +01:00
dsehnal	289dc09eae	add support for atom_site.pdbx_sifts_xref export	2022-02-07 17:33:11 +01:00
Alexander Rose	beff1ecb3e	add model-archive cif schema	2021-12-11 16:40:29 -08:00
Alexander Rose	3400c8e94a	update coreCif dictionary	2021-09-12 16:19:23 -07:00
Alexander Rose	60d5e85b4c	moved rcsb code to extensions folder	2020-04-14 16:35:34 -07:00
Alexander Rose	c6efa475a5	better cif-core data naming	2020-04-10 19:47:54 -07:00
Alexander Rose	0f22eab8b9	support matrix type for cif-core schema	2020-04-10 19:25:05 -07:00
Alexander Rose	e90ccfdd20	basic support for models from cif-core files	2020-04-09 18:42:33 -07:00
Alexander Rose	0cc077c346	more cif-core fields	2020-04-09 17:31:17 -07:00
Alexander Rose	9fa56bf76c	readded citschema and cif2bcif apps back from ciftools package ... - easier to maintain	2020-04-08 20:08:35 -07:00
Alexander Rose	bb6b6f9690	updated data.rcsb.org url and schema	2020-04-08 16:23:13 -07:00
Alexander Rose	c946ae6eab	updated schemas, emmit .ts instead of .d.ts	2020-02-21 16:01:41 -08:00
Alexander Rose	29ae78c193	assembly symmetry: use https	2020-02-14 09:34:50 -08:00
Alexander Rose	57ed9a4226	updated cif schemas	2020-02-12 18:50:52 -08:00
Alexander Rose	5a714af309	use skipTypename for rcsb graphql codegen	2020-02-07 18:18:17 -08:00
Alexander Rose	961f847765	updated rcsb graphql schema and url	2020-02-05 14:22:16 -08:00
Alexander Rose	9341c19bd5	updated graphql codegen script	2020-01-24 18:12:10 -08:00
Alexander Rose	b7216d28f4	wip, cif-core support	2019-11-08 21:12:01 -05:00
Alexander Rose	69da5abb88	use staging url for rcsb graphql	2019-06-13 09:25:50 -07:00
Alexander Rose	1694a8d517	removed code factored out into outher packages	2019-06-04 15:47:34 -07:00
Alexander Rose	aa481fc698	entity-source coloring (replaces gene coloring)	2019-05-20 07:55:33 -07:00
Alexander Rose	9f6e65918d	cif schema updates	2019-05-11 22:03:45 -07:00
Alexander Rose	30dca2f2e9	tweaked graphql codegen to work with new version	2019-03-01 14:50:29 -08:00
Alexander Rose	8c49783c12	wip, graphql schema gen (currently broken)	2019-01-17 16:19:07 -08:00
Alexander Rose	07a97e6ec6	updated rcsb_assembly_symmetry	2018-10-31 16:09:24 -07:00
Alexander Rose	b7f005f427	updated cif schemas, added chem_comp_related and chem_comp_synonyms	2018-10-24 14:14:35 -07:00
David Sehnal	c91b826f24	added pdbx_nonpoly_scheme category to mmCIF schema and export	2018-10-11 15:06:10 +02:00
Alexander Rose	af192a3b3c	wip, carbohydrates and branched entity	2018-09-20 10:41:11 -07:00
Alexander Rose	ea02fe832f	wip, carbohydrate related schema additions	2018-09-19 18:20:20 -07:00
Alexander Rose	c8684c17c7	tweaks for coarse/backbone only models	2018-09-17 11:49:51 -07:00
Alexander Rose	5ae732b226	updated rcsb assembly symmetry	2018-08-17 12:08:08 -07:00
Alexander Rose	8802f518d7	wip, symmetry annotation, graphql schema codegen	2018-08-03 18:26:57 -07:00
David Sehnal	fa912a1d66	Work on mmCIF exporter	2018-07-11 16:51:30 +02:00
Alexander Rose	0fb6ed11f6	added some missing ihm fields	2018-06-26 20:15:50 -07:00
David Sehnal	f94007bef2	Parse and generate NCS operators	2018-06-15 11:43:08 +02:00
David Sehnal	059a09d63e	Added spacegroups to mol-model	2018-05-10 12:47:16 +02:00
David Sehnal	22d208ff33	added Model.sequence	2018-04-26 16:57:10 +02:00
Alexander Rose	47c1ac3b77	added ihm extension to mmcif schema	2018-04-24 18:12:43 -07:00
Alexander Rose	75c686891d	added more useful mmcif fields	2018-03-20 20:24:10 -07:00
Alexander Rose	a68a188600	added bird related fields to mmcif schema	2018-03-16 13:39:52 -07:00
Alexander Rose	ac614ebd32	updated mmcif: reordered, added chem_comp, entry, struct, struct_keywords	2018-03-15 16:04:21 -07:00
Alexander Rose	e9b57bb89b	improved schema generation from mmcif dic	2018-03-14 11:48:06 -07:00
Alexander Rose	c73f68023f	added CCD schema	2018-03-05 18:31:37 -08:00
Alexander Rose	c36c3f0d13	added code generated mmcif schema based on popular fields	2018-02-23 20:26:28 -08:00
Alexander Rose	8356184565	wip, schema generation scripts	2018-02-20 18:18:01 -08:00