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pingzhili
/
cg-schnet
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0
English
molecular-dynamics
coarse-grained
schnet
force-field
protein
arxiv:
2602.13140
License:
mit
Model card
Files
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cg-schnet
/
configurations
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1 commit
pingzhili
Add pre-trained CGSchNet model, protein configurations, and PDB structures
1f53d02
verified
about 2 months ago
1d3z_with_ext_PUMA_configurations.pt
pickle
Detected Pickle imports (9)
"torch.LongStorage"
,
"torch.FloatStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"torch.DoubleStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"collections.OrderedDict"
,
"torch_geometric.data.data.DataTensorAttr"
,
"torch_geometric.data.data.DataEdgeAttr"
,
"mlcg.data.atomic_data.AtomicData"
How to fix it?
15.6 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
1enh_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
1.79 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
1enh_elongated_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
8.93 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
1fme_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
4.67 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
1ris_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
2.81 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
1yrf_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
1.56 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
2a3d_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
1.59 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
2a3d_elongated_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
7.9 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
2ci2_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
2.54 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
2jof_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
3.5 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
2nuz_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
1.84 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
3zbe_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"torch.DoubleStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"collections.OrderedDict"
,
"torch.LongStorage"
,
"mlcg.data.atomic_data.AtomicData"
How to fix it?
23 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
cln_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
3.06 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
ext_PUMA_alone_configurations.pt
pickle
Detected Pickle imports (9)
"torch.LongStorage"
,
"torch.FloatStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"torch.DoubleStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"collections.OrderedDict"
,
"torch_geometric.data.data.DataTensorAttr"
,
"torch_geometric.data.data.DataEdgeAttr"
,
"mlcg.data.atomic_data.AtomicData"
How to fix it?
12 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
mcl1_with_ext_PUMA_configurations.pt
pickle
Detected Pickle imports (9)
"torch.LongStorage"
,
"torch.FloatStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"torch.DoubleStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"collections.OrderedDict"
,
"torch_geometric.data.data.DataTensorAttr"
,
"torch_geometric.data.data.DataEdgeAttr"
,
"mlcg.data.atomic_data.AtomicData"
How to fix it?
51.7 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
opep_0015_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
4.35 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
opep_0034_configurations.pt
pickle
Detected Pickle imports (7)
"torch.FloatStorage"
,
"torch_geometric.data.storage.GlobalStorage"
,
"mlcg.data.atomic_data.AtomicData"
,
"torch.LongStorage"
,
"torch.DoubleStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"collections.OrderedDict"
How to fix it?
4.14 MB
xet
Add pre-trained CGSchNet model, protein configurations, and PDB structures
about 2 months ago
