release v0.1.0

BIMSBbioinfo · Sep 25, 2024 · 585bedf · 585bedf
1 parent 10261a1
commit 585bedf
Show file tree

Hide file tree

Showing 220 changed files with 71,071 additions and 8,919 deletions.
diff --git a/.gitignore b/.gitignore
@@ -19,12 +19,16 @@ cache_torsion/
 cache_torsion_allatoms/
 PLM/
 DiffDock/data/splits/finetune/old_splits/
+others/
+scripts/
+*_esm2_*/
+*.pt
+*.fasta
 DiffDock/bootstrapping/
 generated_data/
 training_new.py
 arcas_experiments/
 run_wandb_summary.py
-data/
 results/
 wandb/
 workdir/

diff --git a/AA_Score_Tool/.gitignore b/AA_Score_Tool/.gitignore