- Generated on Thu Dec 28 2023 13:22:51 for OpenMD by
1.10.0
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OpenMD 3.0
Molecular Dynamics in the Open
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This is the complete list of members for OpenMD::ForceField, including all inherited members.
| addAtomType(const std::string &at, AtomType *atomType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| addBendType(const std::string &at1, const std::string &at2, const std::string &at3, BendType *bendType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| addBondType(const std::string &at1, const std::string &at2, BondType *bondType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| addInversionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4, InversionType *inversionType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| addNonBondedInteractionType(const std::string &at1, const std::string &at2, NonBondedInteractionType *nbiType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| addTorsionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4, TorsionType *torsionType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| atomTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| AtomTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| atypeIdentToName (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| bendTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| BendTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| bondTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| BondTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| ForceField(std::string ffName) | OpenMD::ForceField | |
| forceFieldOptions_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| getAtomType(const std::string &at) | OpenMD::ForceField | |
| getAtomType(int ident) | OpenMD::ForceField | |
| getAtomTypes() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| getBendType(const std::string &at1, const std::string &at2, const std::string &at3) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getBondType(const std::string &at1, const std::string &at2) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getExactBendType(const std::string &at1, const std::string &at2, const std::string &at3) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getExactBondType(const std::string &at1, const std::string &at2) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getExactInversionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getExactNonBondedInteractionType(const std::string &at1, const std::string &at2) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getExactTorsionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getForceFieldFileName() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| getForceFieldOptions() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| getInversionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getNAtomType() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| getNonBondedInteractionType(const std::string &at1, const std::string &at2) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getNonBondedInteractionTypes() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| getRcutFromAtomType(AtomType *at) (defined in OpenMD::ForceField) | OpenMD::ForceField | virtual |
| getTorsionType(const std::string &at1, const std::string &at2, const std::string &at3, const std::string &at4) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| getWildCard() (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| inversionTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| InversionTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| nonBondedInteractionTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| NonBondedInteractionTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| openForceFieldFile(const std::string &filename) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| parse(const std::string &filename) (defined in OpenMD::ForceField) | OpenMD::ForceField | virtual |
| replaceAtomType(const std::string &at, AtomType *atomType) (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| setForceFieldFileName(const std::string &filename) (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| setWildCard(const std::string &wildCard) (defined in OpenMD::ForceField) | OpenMD::ForceField | inline |
| spMan_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| torsionTypeCont_ (defined in OpenMD::ForceField) | OpenMD::ForceField | protected |
| TorsionTypeContainer typedef (defined in OpenMD::ForceField) | OpenMD::ForceField | |
| ~ForceField()=default (defined in OpenMD::ForceField) | OpenMD::ForceField | virtual |
1.10.0