Esempio n. 1
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def do_fit(weights, atomsvec1, atomsvec2, natoms=None, dimensions=3):
    if mNumPy:
        if natoms == None:
            if not len(weights) == len(atomsvec1) == len(atomsvec2):
                raise TypeError("Array dimension don't match")
            natoms = len(weights)
    libgmx.do_fit_ndim(dimensions, natoms, weights, atomsvec1, atomsvec2)
Esempio n. 2
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def do_fit(weights,atomsvec1,atomsvec2,natoms=None,dimensions=3):
    if mNumPy:
        if natoms==None:
            if not len(weights)==len(atomsvec1)==len(atomsvec2):
                raise TypeError("Array dimension don't match")
            natoms=len(weights)
    libgmx.do_fit_ndim(dimensions,natoms,weights,atomsvec1,atomsvec2)
Esempio n. 3
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def do_fit(natoms,weights,atomsvec1,atomsvec2,dimensions=3):
    libgmx.do_fit_ndim(dimensions,natoms,weights,atomsvec1,atomsvec2)
Esempio n. 4
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def do_fit(natoms, weights, atomsvec1, atomsvec2, dimensions=3):
    libgmx.do_fit_ndim(dimensions, natoms, weights, atomsvec1, atomsvec2)