From 9814767f6769c2627ebebf849abcd5a4541d5880 Mon Sep 17 00:00:00 2001
From: BOULANGEOT Nathan <nathan.boulangeot@univ-lorraine.fr>
Date: Fri, 24 Jan 2025 17:20:00 +0000
Subject: [PATCH] Update run.py
---
run.py | 2 +-
1 file changed, 1 insertion(+), 1 deletion(-)
diff --git a/run.py b/run.py
index 992d4d2..17cacc0 100644
--- a/run.py
+++ b/run.py
@@ -59,6 +59,6 @@ if __name__ == '__main__':
parameters = {'alpha':[1e-4,]}
g_search = GridSearchCV(GP, parameters)
g_search.fit(X_train, y_train)
-
+ desc.ats=-1
Parallel(n_jobs=10)(delayed(run_para)([xx[i],yy[i],zz[i]],i,desc,scaler,g_search,poscar=atoms) for i in range(len(xx)))
\ No newline at end of file
--
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