How to use the mdanalysis.Analyzer function in MDAnalysis

To help you get started, we’ve selected a few MDAnalysis examples, based on popular ways it is used in public projects.

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github maxscheurer / pycontact / mdanalysis.py View on Github external
def __init__(self, psf, dcd, cutoff, hbondcutoff, hbondcutangle, sel1text, sel2text):
        super(Analyzer, self).__init__()
        self.psf = psf
        self.dcd = dcd
        self.cutoff = cutoff
        self.hbondcutoff = hbondcutoff
        self.hbondcutangle = hbondcutangle
        self.sel1text = sel1text
        self.sel2text = sel2text