added main call for distributed gibbs running

Becksteinlab · Feb 22, 2024 · 46666fa · 46666fa
1 parent fe2fb3d
commit 46666fa
Showing 1 changed file with 2 additions and 0 deletions.
diff --git a/basicrta/gibbs.py b/basicrta/gibbs.py
@@ -382,4 +382,6 @@ def estimate_tau(self):
     parser.add_argument('--resid', type=int)
     args = parser.parse_args()
 
+    cutoff = args.contacts.split('/')[-1].strip('.pkl').split('_')[-1]
+    os.chdir(f'basicrta-{cutoff}')
     ParallelGibbs(args.contacts).run(run_resids=args.resid)