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Trying to run mdacli>=0.1.20 results in
mdacli>=0.1.20
(base) hjaeger@argali:/work/hjaeger/spce_water$ maicos densityplanar -s run.tpr -f run.xtc -atomgroups 'resname SOL' Logging to file is disabled. Gromacs version : b'VERSION 2022-beta1-dev-20211122-4f4b9e4b19-unknown' tpx version : 127 tpx generation : 28 tpx precision : 4 tpx file_tag : b'release' tpx natoms : 7500 tpx ngtc : 1 tpx fep_state : 0 tpx lambda : 0.0 Error: run() got an unexpected keyword argument 'num_threads'
since the newly introduced -nt argument gets passed to the run function of the analysis class.
-nt
The text was updated successfully, but these errors were encountered:
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Trying to run
mdacli>=0.1.20
results insince the newly introduced
-nt
argument gets passed to the run function of the analysis class.The text was updated successfully, but these errors were encountered: