Commit 53f32530 authored by zhanggzh's avatar zhanggzh
Browse files

add torchani src code

parent 17204c6d
......@@ -3,7 +3,7 @@ from ase.md.langevin import Langevin
from ase.md.nptberendsen import NPTBerendsen
from ase import units
from ase.io import read
from ase.calculators.test import numeric_force
from ase.calculators.fd import _numeric_force as numeric_force
from torchani.testing import TestCase
import numpy as np
import torch
......
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