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Searched defs:gapMax (Results 1 – 5 of 5) sorted by relevance

/dports/science/ergo/ergo-3.8/source/densfromf/
H A DGetDensFromFock.cc496 …ergo_real gapMax = lumoInterval_F_ort_prev_expanded.upp() - homoInterval_F_ort_prev_expanded.low(); in get_dens_from_fock_sparse() local
911 ergo_real gapMax = lumoInterval_F_ort_prev.upp() - homoInterval_F_ort_prev.low(); in get_dens_from_fock_sparse() local
/dports/science/py-pymol/pymol-open-source-2.4.0/modules/cealign/src/
H A Dccealignmodule.cpp156 … dA, double** dB, int lenA, int lenB, float D0, float D1, int winSize, int gapMax, int * bufferSiz… in findPath()
/dports/science/ergo/ergo-3.8/source/scf/
H A DSCF_restricted.cc524 ergo_real gapMax = lumoInterval.upp() - homoInterval.low(); in get_2e_part_and_energy() local
/dports/cad/gmsh/gmsh-4.9.2-source/contrib/QuadMeshingTools/
H A DqmtMeshGeometryOptimization.cpp639 double gapMax[2] = {0., 0.}; in getContinuousUVOnLoop() local
/dports/science/py-pymol/pymol-open-source-2.4.0/layer3/
H A DExecutive.cpp16444 …ct * listA, PyObject * listB, int lenA, int lenB, float d0, float d1, int windowSize, int gapMax) { in ExecutiveCEAlign()