Closed ojeda-e closed 3 years ago
The initial version of the code uses the mdtraj library. Next step is to replace all functions from mdtraj by MDAnalysis modules and adjust the code wherever is necessary.
mdtraj
MDAnalysis
Changes required in
core.py
/lib/mods.py
The initial version of the code uses the
mdtraj
library. Next step is to replace all functions frommdtraj
byMDAnalysis
modules and adjust the code wherever is necessary.Changes required in
core.py
/lib/mods.py
.