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Testing a trained model about schnetpack HOT 4 OPEN

MasterLucas avatar MasterLucas commented on August 26, 2024
Testing a trained model

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Comments (4)

jnsLs avatar jnsLs commented on August 26, 2024

Dear Lucas,

are you using the latest version (commit) of SchNetPack?

Best, Jonas

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MasterLucas avatar MasterLucas commented on August 26, 2024

Dear Jonas,

I tried to check the SchNetPack version I am using but was unable to. I created the environment a few months ago, so I don't know if a new version has been released since then.

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jnsLs avatar jnsLs commented on August 26, 2024

Do you remember how you installed it? pypi or from source

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jnsLs avatar jnsLs commented on August 26, 2024

Hi Lucas,

have you figured out the problem yet?
If not, the problem here is most likely, that you are loading a torch.nn.Module but the pytorch-lightning Trainer.test method requires a pytorch_lightning.LightningModule

Best, Jonas

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