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All Samples(5)  |  Call(2)  |  Derive(0)  |  Import(3)

src/f/r/fragit-main-HEAD/src/qmmm.py   fragit-main(Download)
 
from util import calculate_hydrogen_position
from util import ravel2D, listDiff, Uniqify
#from config import FragItConfig
 
        remove_breaks = []
        for ibreak, bbreak in enumerate(breaks):
            lendiff = len(listDiff(fragments_for_qm_no_hydrogens, list(bbreak)))
            difflen = lenqmfrags - lendiff
 
        # lets find the associated fragments
        for ifg,atoms in enumerate(self._fragments):
            if len(atoms) > len(listDiff(atoms, other_fragment_atomids)):
                other_fragments.append(ifg)
 

src/f/r/fragit-main-HEAD/src/xyzmfcc.py   fragit-main(Download)
from util import file_extension,is_list,listTo2D,join2D,is_int
from util import listToRanges,listOfRangesToString,Uniqify,ravel2D
from util import deepLength,listDiff,intlistToString
from util import getFilenameAndExtension
from util import shares_elements, calculate_hydrogen_position

src/f/r/fragit-main-HEAD/src/xyz.py   fragit-main(Download)
from util import file_extension,is_list,listTo2D,join2D,is_int
from util import listToRanges,listOfRangesToString,Uniqify,ravel2D
from util import deepLength,listDiff,intlistToString
from util import getFilenameAndExtension