15 Commits

Author	SHA1	Message	Date
Dima	f0e12dc659	Install modelcif for pulldown.dockerfile	2024-07-23 11:08:13 +02:00
Dingquan Yu	baed41fa26	Update pulldown.dockerfile ... switched the installation order	2024-07-02 14:35:21 +02:00
maurerv	4c9ef32876	Moved to classic solver	2024-06-14 13:40:12 +02:00
maurerv	f78da683ab	Moved to classic solver	2024-06-14 11:30:53 +02:00
Dingquan Yu	30bfc6d283	Update pulldown.dockerfile	2024-06-12 13:50:34 +02:00
Dingquan Yu	2c42567b2f	Update pulldown.dockerfile	2024-06-12 13:43:38 +02:00
Dingquan Yu	7a5ad14e69	Update pulldown.dockerfile	2024-06-12 13:37:50 +02:00
Dingquan Yu	9cf1ccf0b6	Update pulldown.dockerfile	2024-06-12 13:32:42 +02:00
Dingquan Yu	4e9e28d016	Update pulldown.dockerfile	2024-06-12 13:25:10 +02:00
Dingquan Yu	cbe103f2cf	Added -y to the apt installations	2024-06-12 13:11:15 +02:00
Dingquan Yu	6a91303822	Update pulldown.dockerfile	2024-06-12 13:02:05 +02:00
Dingquan Yu	a8006a9648	Update pulldown.dockerfile	2024-06-12 12:51:28 +02:00
Dingquan Yu	29bb486ea2	Update pulldown.dockerfile	2024-06-12 12:11:36 +02:00
maurerv	91e276a182	Updated container creation to distinguish between push and release events. AlphaPulldown source code will now be pulled from the main branch upon container creation and not from PyPi	2024-06-10 09:45:09 +02:00
Dima	67b89f94f9	Snakemake docker (#317) ... * Copied from https://github.com/maurerv/alphaabriss * CI/CD * Restructured snakemake workflow topology. Updated Dockerfile to compatible jax cuda versions. Included analysis container in CI/CD * Run container build in parallel * Free container space for analysis image * Updated container paths in Snakefile * Moved snakemake pipeline to kosinskilab/AlphaPulldownSnakemake * Added tag for container from the release. Add test_feats_with_templates --------- Co-authored-by: maurerv <valentin.maurer@embl-hamburg.de>	2024-04-25 11:18:14 +02:00