enable use of CVs defined by PyTorch neural network models #1212
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test-backends.yml
on: pull_request
LAMMPS
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test_backends
13m 8s
NAMD
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test_backends
8m 34s
NAMD3 (no CUDA)
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test_backends
6m 59s
VMD
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test_backends
4m 2s
GROMACS 2021
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test_backends
18m 16s
GROMACS 2022
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test_backends
19m 3s
GROMACS 2023
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test_backends
20m 58s