PLMD::ERMSD Member List

This is the complete list of members for PLMD::ERMSD, including all inherited members.

calcMat(const std::vector< Vector > &positions, const Pbc &pbc, std::vector< Vector4d > &mat, std::vector< TensorGeneric< 4, 3 > > &Gderivatives)PLMD::ERMSD
calculate(const std::vector< Vector > &positions, const Pbc &pbc, std::vector< Vector > &derivatives, Tensor &virial)PLMD::ERMSD
clear()PLMD::ERMSD
cutoffPLMD::ERMSDprivate
ERMSD()PLMD::ERMSDinline
inPair(unsigned i, unsigned j)PLMD::ERMSD
natomsPLMD::ERMSDprivate
nresiduesPLMD::ERMSDprivate
pairsPLMD::ERMSDprivate
reference_matPLMD::ERMSDprivate
setReference(const std::vector< Vector > &reference, const std::vector< unsigned > &pairs_vec, double mycutoff=0.24)PLMD::ERMSD