search

UCL-CCS / TIES

Topology Superimposition based on joint graph traversal
MIT License
5 stars 1 forks source link

Separate the ambertools output into a file rather than polluting the general space #214

Closed bieniekmateusz closed 3 years ago

bieniekmateusz commented 3 years ago

create a function that takes care of all the calls, ideally packs them into directories and separates the output, in case of an error, point the user to the file with the error