Closed ppxwwtaking closed 4 months ago
I did not have any problems before today I run "apt --fix-broken install" to fix some inconsistency issue.
Here is the apt log file (attached). history.log
The problem happens when chroma.design() is used. I found cuda was not available before the nvidia driver was updated, therefore all tensors used 'cpu'. Now cuda is available, the RuntimeError persists; there is no problem with other examples except for the redesign.
hey,
have you tried protein = Protein('1GFP', device='cuda')
?
hey,
have you tried
protein = Protein('1GFP', device='cuda')
?
Thanks. It works now. I thought somewhere I should specify the device, but I could not find chroma.design.
I run the following redesign code
Redesign a Protein
from chroma import Protein, Chroma chroma = Chroma() protein = Protein('1GFP') protein = chroma.design(protein) protein.to("1GFP-redesign.cif")
It comes with errors (attached). errors.txt