TypeError: Unit "kilocalorie/mole" is not compatible with Unit "kilojoule/(nanometer*mole)".

Graylab / IgFold

Fast, accurate antibody structure prediction from deep learning on massive set of natural antibodies

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TypeError: Unit "kilocalorie/mole" is not compatible with Unit "kilojoule/(nanometer*mole)". #66

Open MQM1608 opened 6 months ago

MQM1608 commented 6 months ago

I'm running your sample code from section "Refinement with OpenMM" but it get error "TypeError: Unit "kilocalorie/mole" is not compatible with Unit "kilojoule/(nanometer*mole)"."