forgetted to call _misc._derivative in the API module

geem-lab · Jan 31, 2025 · 3d638ac · 3d638ac
1 parent f2298e4
commit 3d638ac
Show file tree

Hide file tree

Showing 2 changed files with 2 additions and 2 deletions.
diff --git a/overreact/api.py b/overreact/api.py
@@ -22,11 +22,11 @@
 from typing import TYPE_CHECKING
 
 import numpy as np
-from findiff import Diff as derivative
 
 import overreact as rx
 from overreact import _constants as constants
 from overreact import coords, rates, tunnel
+from overreact._misc import _derivative as derivative
 
 if TYPE_CHECKING:
     from overreact.core import Scheme

diff --git a/overreact/coords.py b/overreact/coords.py
@@ -1682,7 +1682,7 @@ def gyradius(atommasses, atomcoords, method="iupac"):
         raise ValueError(msg)
 
 
-#@rx._misc.copy_unhashable()
+@rx._misc.copy_unhashable()
 def inertia(atommasses, atomcoords, align=True):
     r"""Calculate primary moments and axes from the inertia tensor.