Commit 47661d47 authored by milafternoon's avatar milafternoon
Browse files

prefiltering for completed runs, fix

parent cf9c73db

processing.py

+2 −2
Original line number Diff line number Diff line
@@ -211,9 +211,9 @@ def filter_completed(jobs): 
        traj_alias = traj.ordering

        folder_name = '/'.join(m.topname.split('/')[:-1])

        os.chdir(folder_name)

        if '{tn}-dhdl.xvg'.format(tn=traj_alias) not in os.listdir(folder_name):

        if '{tn}-dhdl.xvg'.format(tn=traj_alias) in os.listdir(folder_name):

            completed.append(n)

            print("in mod {fname} skipping trajectory {tn}, already calculated".format(fname=folder_name,

            print("in mod {fname} skipping trajectory {tn}: already calculated".format(fname=folder_name,

                                                                                       tn=traj_alias))

    completed.sort(reverse=True)

    for i in completed: