add `minimization_output_${datFileBase}.dat` to results.tar.gz - Githubissues

bl1231 / bilbomd-worker

Processes BilboMD jobs and run CHARMM, FoXS, and MultiFoXS

1 stars 0 forks source link

add `minimization_output_${datFileBase}.dat` to results.tar.gz #513

Closed dsclassen closed 6 days ago

dsclassen commented 6 days ago

[x] test BilboMD Classic w/PDB
[x] test BilboMD Classic w/CRD/PSF
[x] test BilboMD Auto