Exemplos de ncf em Python

Exemplo n.º 1

    def test_not_within(self):
        from MDAnalysis.analysis.density import notwithin_coordinates_factory as ncf

        vers1 = ncf(self.u, 'resname SOL', 'protein', 2, not_within=True, use_kdtree=True)()
        vers2 = ncf(self.u, 'resname SOL', 'protein', 2, not_within=True, use_kdtree=False)()

        assert_equal(vers1, vers2)

Exemplo n.º 2

Arquivo: test_density.py Projeto: MDAnalysis/mdanalysis

    def test_not_within(self, u):
        from MDAnalysis.analysis.density import notwithin_coordinates_factory as ncf

        vers1 = ncf(u, 'resname SOL', 'protein', 2, not_within=True, use_kdtree=True)()
        vers2 = ncf(u, 'resname SOL', 'protein', 2, not_within=True, use_kdtree=False)()

        assert_equal(vers1, vers2)