aiqm / torchani

Accurate Neural Network Potential on PyTorch
https://aiqm.github.io/torchani/
MIT License
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ANI-2x dataset files #626

Closed rschireman closed 1 year ago

rschireman commented 1 year ago

Hi all,

I'm not really sure where to ask this, but is there anyway we could get access to the .h5 file for the ANI-2x dataset for benchmarking models?

roitberg commented 1 year ago

Hi. Email me directly to roitberg@ufl.edu and we can share them with you

rschireman commented 1 year ago

sounds great!

rschireman commented 1 year ago

I'll leave my academic email here too and close the issue!

rschirem@uvm.edu

Thanks again!