from gpu_decoy_class import ComplexDecoy if __name__ == "__main__": import sys complx_name = sys.argv[1] complx = ComplexDecoy(complx_name) complx.cleanAll() complx.vstackAll() complx.sortMcc() complx.splitSortedMcc() complx.printMccEner()
from gpu_decoy_class import ComplexDecoy if __name__ == "__main__": import sys complx_name = sys.argv[1] complx = ComplexDecoy(complx_name) complx.cleanAll() complx.extractMccTotalEner(shuffled=True) z_score = complx.calculateWholeZ_Score() print complx_name, z_score ################################################################################ # z_scores = complx.calculatePartialZ_Score(step=1000) # for i in z_scores: # print i
from gpu_decoy_class import ComplexDecoy if __name__ == "__main__": import sys complx_name = sys.argv[1] complx = ComplexDecoy(complx_name) complx.extractTrack()
from lst_sub import getLst from gpu_decoy_class import ComplexDecoy if __name__ == "__main__": import sys lst_fn = sys.argv[1] complxes = getLst(lst_fn) for complx_name in complxes: complx = ComplexDecoy(complx_name) complx.checkClusteringRslt()