OpenMD 3.2
Molecular Dynamics in the Open
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Todo List
Class OpenMD::BaseAtomVisitor
document
Member OpenMD::Bend::calcForce (RealType &angle, bool doParticlePot)
still a lot left to improve
Class OpenMD::BlockSnapshotManager
document
Class OpenMD::ChebyshevT
document
Class OpenMD::ChebyshevU
document
Class OpenMD::ConstraintPair
document
Class OpenMD::CubicBendType
document
Class OpenMD::CubicBondType
document
Class OpenMD::CubicTorsionType
document
Class OpenMD::DataStorage
DataStorage may need refactoring. Every vector can inherit from the same base class which will make it easy to maintain
Class OpenMD::DLM
document
Class OpenMD::DumpReader
get rid of more junk code from DumpReader
Class OpenMD::DumpWriter
Member OpenMD::getPrefix (const std::string &str)
need implementation
Member OpenMD::GhostBend::calcForce (RealType &angle, bool doParticlePot)
still a lot left to improve
Class OpenMD::HarmonicBendType
documentation
Class OpenMD::HydrodynamicsModel
document
Class OpenMD::HydrodynamicsModelBuilder< ConcreteHydrodynamicsModel >
document
Class OpenMD::IndexListContainer
documentation
Class OpenMD::Integrator
document
Class OpenMD::IntegratorBuilder< ConcreteIntegrator >
document
Class OpenMD::Lattice
document
Class OpenMD::LatticeBuilder< ConcreteLattice >
document
Class OpenMD::LegendrePolynomial
document
Class OpenMD::NVT
document
Class OpenMD::PolynomialBendType
documentation
Class OpenMD::PolynomialBondType
documentation
Class OpenMD::PolynomialInversionType
documentation
Class OpenMD::PolynomialTorsionType
documentation
Class OpenMD::QuarticBendType
document
Class OpenMD::QuarticBondType
document
Class OpenMD::QuarticTorsionType
document
Member OpenMD::RectMatrix< Real, Row, Col >::operator== (const RectMatrix< Real, Row, Col > &m)
replace operator == by template function equal
Member OpenMD::RigidBody::calcRefCoords ()
need modification
Class OpenMD::SectionParser
document
Class OpenMD::SelectionCompiler
document
Member OpenMD::SquareMatrix3< Real >::diagonalize (SquareMatrix3< Real > &a, Vector3< Real > &w, SquareMatrix3< Real > &v)
Member OpenMD::SquareMatrix< Real, Dim >::diagonalize ()
 need implementation
Class OpenMD::Token 
 document
Member OpenMD::TypeContainer< ElemType, SIZE >::find (KeyType &keys, const std::string &wildCard)
Class OpenMD::UreyBradleyBendType 
 documentation
Class OpenMD::ZConsReader 
 document
Member OpenMD::ZConsVisitor::ZConsVisitor (SimInfo *info)
 only works for single version now