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bioexcel / gromacs-docker

Dockerfile for GROMACS
MIT License
44 stars 19 forks source link

Create GROMACS 2020.6 images #16

Closed douglowe closed 2 years ago

douglowe commented 2 years ago

We are also adding in the gmx_chooser fix here.

mabraham commented 2 years ago

I made https://github.com/bioexcel/gromacs-hpccm-recipes-mult-stages/pull/2 to remove the artificial barrier that I think affects this. Does that look right to you?