pablo-arantes / making-it-rain

Cloud-based molecular simulations for everyone
MIT License
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torch update command added before torchani #51

Closed quantaosun closed 1 year ago

quantaosun commented 1 year ago

Hi there,

I just added an update on the torch since I found in my case, it only worked once I did that. It seems to me, over time there is a risk of an unmatched version of torch and torchani since the latter seems to require the latest torch, so it might be better to have an update command for torch there.

Cheers,

Q