Nevensky gmxplumed issues - Githubissues

Nevensky / gmxplumed

Dockerfile for Gromacs wih GPU support and PLUMED plugin.

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Update to Gromacs 2020.2

#8 Nevensky opened 4 years ago
0
What is the mdrun command?

#7 Dan-Burns opened 4 years ago
1
Upgrade the plumed version 2.5.0 to 2.5.1/2.5.2 of gmxplumed

#6 srp106 closed 5 years ago
0
Add a Codacy badge to README.md

#5 codacy-badger closed 5 years ago
0
add more cuda/gromacs/plumed versions and cpu-only variants

#4 Nevensky opened 5 years ago
0
create base and runtime Dockerfiles

#3 Nevensky opened 5 years ago
0
isolate plumed from /usr/local

#2 Nevensky closed 5 years ago
1
plumed can't be compiled with AVX

#1 Nevensky opened 5 years ago
0