[pre-commit.ci] auto fixes from pre-commit.com hooks

for more information, see https://pre-commit.ci

mddatasetbuilder/datasetbuilder.py

@@ -344,7 +344,7 @@ def _calcoulumbmatrix(self, atoms):
         with np.errstate(divide="ignore", invalid="ignore"):
             np.divide(top, r, top)
             np.fill_diagonal(top, diag)
-        top[top == np.Infinity] = 0
+        top[top == np.inf] = 0
         top[np.isnan(top)] = 0
         return np.linalg.eigh(top)[0]