From a73f87e159d33e33eab5aca4ca6fcd015e3aec77 Mon Sep 17 00:00:00 2001
From: Niklas Gebauer <2736079+NiklasGebauer@users.noreply.github.com>
Date: Fri, 2 Sep 2022 20:58:02 +0200
Subject: [PATCH] Fix error in AddOffsets

The atomrefs should be added instead of subtracted here.
---
 src/schnetpack/transform/atomistic.py | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/src/schnetpack/transform/atomistic.py b/src/schnetpack/transform/atomistic.py
index a13672853..cc7a09ee6 100644
--- a/src/schnetpack/transform/atomistic.py
+++ b/src/schnetpack/transform/atomistic.py
@@ -227,6 +227,6 @@ def forward(
             if not self.is_extensive:
                 y0 /= inputs[structure.n_atoms]
 
-            inputs[self._property] -= y0
+            inputs[self._property] += y0
 
         return inputs