Molmodel

SimTK::DuMMForceFieldSubsystem Member List

This is the complete list of members for SimTK::DuMMForceFieldSubsystem, including all inherited members.
addAtom(DuMM::ChargedAtomTypeIndex chargedAtomTypeIx)SimTK::DuMMForceFieldSubsystem
addBond(DuMM::AtomIndex atom1Ix, DuMM::AtomIndex atom2Ix)SimTK::DuMMForceFieldSubsystem
adoptMeasure(AbstractMeasure &)SimTK::Subsystem
adoptSubsystemGuts(Subsystem::Guts *g)SimTK::Subsystem
allocateAutoUpdateDiscreteVariable(State &, Stage invalidates, AbstractValue *v, Stage updateDependsOn) const SimTK::Subsystem
allocateCacheEntry(const State &, Stage dependsOn, Stage computedBy, AbstractValue *v) const SimTK::Subsystem
allocateCacheEntry(const State &state, Stage g, AbstractValue *v) const SimTK::Subsystem
allocateDiscreteVariable(State &, Stage invalidates, AbstractValue *v) const SimTK::Subsystem
allocateEventTriggersByStage(const State &, Stage, int ntriggers) const SimTK::Subsystem
allocateLazyCacheEntry(const State &state, Stage earliest, AbstractValue *v) const SimTK::Subsystem
allocateQ(State &, const Vector &qInit) const SimTK::Subsystem
allocateQErr(const State &, int nqerr) const SimTK::Subsystem
allocateU(State &, const Vector &uInit) const SimTK::Subsystem
allocateUDotErr(const State &, int nudoterr) const SimTK::Subsystem
allocateUErr(const State &, int nuerr) const SimTK::Subsystem
allocateZ(State &, const Vector &zInit) const SimTK::Subsystem
attachAtomToBody(DuMM::AtomIndex atomIx, MobilizedBodyIndex body, const Vec3 &station=Vec3(0))SimTK::DuMMForceFieldSubsystem
attachClusterToBody(DuMM::ClusterIndex clusterIx, MobilizedBodyIndex body, const Transform &X_BC=Transform())SimTK::DuMMForceFieldSubsystem
calcClusterMassProperties(DuMM::ClusterIndex clusterIx, const Transform &X_BC=Transform()) const SimTK::DuMMForceFieldSubsystem
clearIncludedBondList()SimTK::DuMMForceFieldSubsystem
clearIncludedNonbondAtomList()SimTK::DuMMForceFieldSubsystem
createCluster(const char *clusterName)SimTK::DuMMForceFieldSubsystem
defineAmberImproperTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity, Real ampInKJ, Real phaseInDegrees)SimTK::DuMMForceFieldSubsystem
defineAmberImproperTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKJ, Real phase1InDegrees, int periodicity2, Real amp2InKJ, Real phase2InDegrees)SimTK::DuMMForceFieldSubsystem
defineAmberImproperTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKJ, Real phase1InDegrees, int periodicity2, Real amp2InKJ, Real phase2InDegrees, int periodicity3, Real amp3InKJ, Real phase3InDegrees)SimTK::DuMMForceFieldSubsystem
defineAmberImproperTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineAmberImproperTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineAmberImproperTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees, int periodicity3, Real amp3InKcal, Real phase3InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineAtomClass(DuMM::AtomClassIndex atomClassIx, const char *atomClassName, int atomicNumber, int expectedValence, Real vdwRadiusInNm, Real vdwWellDepthInKJ)SimTK::DuMMForceFieldSubsystem [inline]
defineAtomClass_KA(DuMM::AtomClassIndex atomClassIx, const char *atomClassName, int element, int valence, Real vdwRadiusInAng, Real vdwWellDepthInKcal)SimTK::DuMMForceFieldSubsystem [inline]
defineAtomClass_KA(int atomClassIx, const char *atomClassName, int element, int valence, Real vdwRadiusInAng, Real vdwWellDepthInKcal)SimTK::DuMMForceFieldSubsystem [inline]
defineBondBend(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, Real stiffnessInKJPerRadSq, Real nominalAngleInDeg)SimTK::DuMMForceFieldSubsystem
defineBondBend_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, Real stiffnessInKcalPerRadSq, Real nominalAngleInDeg)SimTK::DuMMForceFieldSubsystem [inline]
defineBondBend_KA(int class1, int class2, int class3, Real stiffnessInKcalPerRadSq, Real nominalAngleInDeg)SimTK::DuMMForceFieldSubsystem [inline]
defineBondStretch(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, Real stiffnessInKJperNmSq, Real nominalLengthInNm)SimTK::DuMMForceFieldSubsystem
defineBondStretch_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, Real stiffnessInKcalPerAngSq, Real nominalLengthInAng)SimTK::DuMMForceFieldSubsystem [inline]
defineBondStretch_KA(int class1, int class2, Real stiffnessInKcalPerAngSq, Real nominalLengthInAng)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity, Real ampInKJ, Real phaseInDegrees)SimTK::DuMMForceFieldSubsystem
defineBondTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKJ, Real phase1InDegrees, int periodicity2, Real amp2InKJ, Real phase2InDegrees)SimTK::DuMMForceFieldSubsystem
defineBondTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKJ, Real phase1InDegrees, int periodicity2, Real amp2InKJ, Real phase2InDegrees, int periodicity3, Real amp3InKJ, Real phase3InDegrees)SimTK::DuMMForceFieldSubsystem
defineBondTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion_KA(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees, int periodicity3, Real amp3InKcal, Real phase3InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion_KA(int class1, int class2, int class3, int class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion_KA(int class1, int class2, int class3, int class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineBondTorsion_KA(int class1, int class2, int class3, int class4, int periodicity1, Real amp1InKcal, Real phase1InDegrees, int periodicity2, Real amp2InKcal, Real phase2InDegrees, int periodicity3, Real amp3InKcal, Real phase3InDegrees)SimTK::DuMMForceFieldSubsystem [inline]
defineChargedAtomType(DuMM::ChargedAtomTypeIndex atomTypeIx, const char *atomTypeName, DuMM::AtomClassIndex atomClassIx, Real partialChargeInE)SimTK::DuMMForceFieldSubsystem [inline]
defineChargedAtomType_KA(DuMM::ChargedAtomTypeIndex atomTypeIx, const char *atomTypeName, DuMM::AtomClassIndex atomClassIx, Real partialChargeInE)SimTK::DuMMForceFieldSubsystem [inline]
defineChargedAtomType_KA(int atomTypeIx, const char *atomTypeName, int atomClassIx, Real partialChargeInE)SimTK::DuMMForceFieldSubsystem [inline]
defineCustomBondBend(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::CustomBondBend *bondBendTerm)SimTK::DuMMForceFieldSubsystem
defineCustomBondStretch(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::CustomBondStretch *bondStretchTerm)SimTK::DuMMForceFieldSubsystem
defineCustomBondTorsion(DuMM::AtomClassIndex class1, DuMM::AtomClassIndex class2, DuMM::AtomClassIndex class3, DuMM::AtomClassIndex class4, DuMM::CustomBondTorsion *bondTorsionTerm)SimTK::DuMMForceFieldSubsystem
defineIncompleteAtomClass(DuMM::AtomClassIndex classIx, const char *name, int elementNumber, int valence)SimTK::DuMMForceFieldSubsystem [protected]
defineIncompleteAtomClass_KA(DuMM::AtomClassIndex classIx, const char *name, int elementNumber, int valence)SimTK::DuMMForceFieldSubsystem [inline, protected]
defineIncompleteChargedAtomType(DuMM::ChargedAtomTypeIndex typeIx, const char *name, DuMM::AtomClassIndex classIx)SimTK::DuMMForceFieldSubsystem [protected]
defineIncompleteChargedAtomType_KA(DuMM::ChargedAtomTypeIndex typeIx, const char *name, DuMM::AtomClassIndex classIx)SimTK::DuMMForceFieldSubsystem [inline, protected]
DuMMForceFieldSubsystem()SimTK::DuMMForceFieldSubsystem
DuMMForceFieldSubsystem(MolecularMechanicsSystem &)SimTK::DuMMForceFieldSubsystem [explicit]
dump() const SimTK::DuMMForceFieldSubsystem
dumpCForceFieldParameters(std::ostream &os, const String &methodName="loadParameters") const SimTK::DuMMForceFieldSubsystem
ForceSubsystem()SimTK::ForceSubsystem
generateBiotypeChargedAtomTypeSelfCode(std::ostream &os) const SimTK::DuMMForceFieldSubsystem
getAllowOpenMMReference() const SimTK::DuMMForceFieldSubsystem
getAmberImproperTorsionGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getAtomBody(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomClassIndex(const String &atomClassName) const SimTK::DuMMForceFieldSubsystem
getAtomClassIndex(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomDefaultColor(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomElement(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomIndexOfIncludedAtom(DuMM::IncludedAtomIndex incAtomIx) const SimTK::DuMMForceFieldSubsystem
getAtomIndexOfNonbondAtom(DuMM::NonbondAtomIndex nonbondAtomIx) const SimTK::DuMMForceFieldSubsystem [inline]
getAtomMass(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomRadius(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getAtomStationInCluster(DuMM::AtomIndex atomIx, DuMM::ClusterIndex clusterIx) const SimTK::DuMMForceFieldSubsystem
getAtomStationOnBody(DuMM::AtomIndex atomIx) const SimTK::DuMMForceFieldSubsystem
getBiotypeChargedAtomType(BiotypeIndex biotypeIx) const SimTK::DuMMForceFieldSubsystem
getBondAtom(DuMM::BondIndex bond, int which) const SimTK::DuMMForceFieldSubsystem
getBondBendGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getBondStretchGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getBondTorsionGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getCacheEntry(const State &, CacheEntryIndex) const SimTK::Subsystem
getChargedAtomTypeIndex(const String &chargedTypeName) const SimTK::DuMMForceFieldSubsystem
getClusterBody(DuMM::ClusterIndex clusterIx) const SimTK::DuMMForceFieldSubsystem
getClusterPlacementInCluster(DuMM::ClusterIndex childClusterIndex, DuMM::ClusterIndex parentClusterIndex) const SimTK::DuMMForceFieldSubsystem
getClusterPlacementOnBody(DuMM::ClusterIndex clusterIx) const SimTK::DuMMForceFieldSubsystem
getCoulombGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getCustomBondBendGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getCustomBondStretchGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getCustomBondTorsionGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getDiscreteVariable(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
getDiscreteVarLastUpdateTime(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
getDiscreteVarUpdateIndex(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
getDiscreteVarUpdateValue(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
getElementDefaultColor(int atomicNumber) const SimTK::DuMMForceFieldSubsystem
getEventTriggersByStage(const State &, Stage) const SimTK::Subsystem
getEventTriggerStartByStage(const State &, Stage) const SimTK::Subsystem
getForceEvaluationCount() const SimTK::DuMMForceFieldSubsystem
getGbsaGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getIncludedAtomIndexOfNonbondAtom(DuMM::NonbondAtomIndex nonbondAtomIx) const SimTK::DuMMForceFieldSubsystem
getMeasure(MeasureIndex) const SimTK::Subsystem
getMeasure_(MeasureIndex mx) const SimTK::Subsystem
getMultipliers(const State &) const SimTK::Subsystem
getMultipliersStart(const State &) const SimTK::Subsystem
getMySubsystemIndex() const SimTK::Subsystem
getName() const SimTK::Subsystem
getNEventTriggersByStage(const State &, Stage) const SimTK::Subsystem
getNextUnusedAtomClassIndex() const SimTK::DuMMForceFieldSubsystem
getNextUnusedChargedAtomTypeIndex() const SimTK::DuMMForceFieldSubsystem
getNMultipliers(const State &) const SimTK::Subsystem
getNQ(const State &) const SimTK::Subsystem
getNQErr(const State &) const SimTK::Subsystem
getNU(const State &) const SimTK::Subsystem
getNUDotErr(const State &) const SimTK::Subsystem
getNUErr(const State &) const SimTK::Subsystem
getNumAtoms() const SimTK::DuMMForceFieldSubsystem
getNumBonds() const SimTK::DuMMForceFieldSubsystem
getNumIncludedAtoms() const SimTK::DuMMForceFieldSubsystem
getNumNonbondAtoms() const SimTK::DuMMForceFieldSubsystem
getNumThreadsInUse() const SimTK::DuMMForceFieldSubsystem
getNumThreadsRequested() const SimTK::DuMMForceFieldSubsystem
getNZ(const State &) const SimTK::Subsystem
getOpenMMPlatformInUse() const SimTK::DuMMForceFieldSubsystem
getQ(const State &) const SimTK::Subsystem
getQDot(const State &) const SimTK::Subsystem
getQDotDot(const State &) const SimTK::Subsystem
getQErr(const State &) const SimTK::Subsystem
getQErrStart(const State &) const SimTK::Subsystem
getQStart(const State &) const SimTK::Subsystem
getSoluteDielectric() const SimTK::DuMMForceFieldSubsystem
getSolventDielectric() const SimTK::DuMMForceFieldSubsystem
getStage(const State &) const SimTK::Subsystem
getSubsystemGuts() const SimTK::Subsystem
getSystem() const SimTK::Subsystem
getU(const State &) const SimTK::Subsystem
getUDot(const State &) const SimTK::Subsystem
getUDotErr(const State &) const SimTK::Subsystem
getUDotErrStart(const State &) const SimTK::Subsystem
getUErr(const State &) const SimTK::Subsystem
getUErrStart(const State &) const SimTK::Subsystem
getUseMultithreadedComputation() const SimTK::DuMMForceFieldSubsystem
getUseOpenMMAcceleration() const SimTK::DuMMForceFieldSubsystem
getUStart(const State &) const SimTK::Subsystem
getVdwGlobalScaleFactor() const SimTK::DuMMForceFieldSubsystem
getVdwMixingRule() const SimTK::DuMMForceFieldSubsystem
getVdwMixingRuleName(VdwMixingRule) const SimTK::DuMMForceFieldSubsystem
getVdwRadius(DuMM::AtomClassIndex atomClassIx) const SimTK::DuMMForceFieldSubsystem
getVdwWellDepth(DuMM::AtomClassIndex atomClassIx) const SimTK::DuMMForceFieldSubsystem
getVersion() const SimTK::Subsystem
getZ(const State &) const SimTK::Subsystem
getZDot(const State &) const SimTK::Subsystem
getZStart(const State &) const SimTK::Subsystem
GutsSimTK::Subsystem [friend]
HalgrenHHG enum valueSimTK::DuMMForceFieldSubsystem
hasAtomClass(DuMM::AtomClassIndex) const SimTK::DuMMForceFieldSubsystem
hasAtomClass(const String &atomClassName) const SimTK::DuMMForceFieldSubsystem
hasChargedAtomType(DuMM::ChargedAtomTypeIndex) const SimTK::DuMMForceFieldSubsystem
hasChargedAtomType(const String &chargedTypeName) const SimTK::DuMMForceFieldSubsystem
hasGuts() const SimTK::Subsystem
includeAllInterbodyBondsBetweenTwoBodies(MobilizedBodyIndex mobod1, MobilizedBodyIndex mobod2)SimTK::DuMMForceFieldSubsystem
includeAllInterbodyBondsForOneAtom(DuMM::AtomIndex atom)SimTK::DuMMForceFieldSubsystem
includeAllInterbodyBondsForOneBody(MobilizedBodyIndex mobod)SimTK::DuMMForceFieldSubsystem
includeAllInterbodyBondsWithBothAtoms(DuMM::AtomIndex atom1, DuMM::AtomIndex atom2)SimTK::DuMMForceFieldSubsystem
includeAllInterbodyBondsWithBothAtoms(DuMM::BondIndex bond)SimTK::DuMMForceFieldSubsystem
includeAllNonbondAtomsForOneBody(MobilizedBodyIndex mobod)SimTK::DuMMForceFieldSubsystem
includeNonbondAtom(DuMM::AtomIndex atom)SimTK::DuMMForceFieldSubsystem
invalidateSubsystemTopologyCache() const SimTK::Subsystem
isCacheValueRealized(const State &, CacheEntryIndex) const SimTK::Subsystem
isDiscreteVarUpdateValueRealized(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
isEmptyHandle() const SimTK::Subsystem
isInSameSystem(const Subsystem &otherSubsystem) const SimTK::Subsystem
isInSystem() const SimTK::Subsystem
isOwnerHandle() const SimTK::Subsystem
isSameSubsystem(const Subsystem &otherSubsystem) const SimTK::Subsystem
isUsingMultithreadedComputation() const SimTK::DuMMForceFieldSubsystem
isUsingOpenMM() const SimTK::DuMMForceFieldSubsystem
isValidAtomClass(DuMM::AtomClassIndex) const SimTK::DuMMForceFieldSubsystem [protected]
Jorgensen enum valueSimTK::DuMMForceFieldSubsystem
Kong enum valueSimTK::DuMMForceFieldSubsystem
loadAmber99Parameters()SimTK::DuMMForceFieldSubsystem
loadTestMoleculeParameters()SimTK::DuMMForceFieldSubsystem
LorentzBerthelot enum valueSimTK::DuMMForceFieldSubsystem
markCacheValueNotRealized(const State &, CacheEntryIndex) const SimTK::Subsystem
markCacheValueRealized(const State &, CacheEntryIndex) const SimTK::Subsystem
markDiscreteVarUpdateValueRealized(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
MolecularMechanicsSystem classSimTK::DuMMForceFieldSubsystem [friend]
operator=(const Subsystem &)SimTK::Subsystem
placeAtomInCluster(DuMM::AtomIndex atomIx, DuMM::ClusterIndex clusterIx, const Vec3 &station)SimTK::DuMMForceFieldSubsystem
placeClusterInCluster(DuMM::ClusterIndex childClusterIndex, DuMM::ClusterIndex parentClusterIndex, const Transform &X_PC)SimTK::DuMMForceFieldSubsystem
populateFromTinkerParameterFile(std::istream &)SimTK::DuMMForceFieldSubsystem
resetIncludedBondListToDefault()SimTK::DuMMForceFieldSubsystem
resetIncludedNonbondAtomListToDefault()SimTK::DuMMForceFieldSubsystem
setAllGlobalScaleFactors(Real s)SimTK::DuMMForceFieldSubsystem [inline]
setAllowOpenMMReference(bool)SimTK::DuMMForceFieldSubsystem
setAmberImproperTorsionGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setAtomClassVdwParameters(DuMM::AtomClassIndex atomClassIx, Real vdwRadiusInNm, Real vdwWellDepthInKJPerMol)SimTK::DuMMForceFieldSubsystem [protected]
setAtomClassVdwParameters_KA(DuMM::AtomClassIndex atomClassIx, Real radiusInAng, Real wellDepthInKcal)SimTK::DuMMForceFieldSubsystem [inline, protected]
setBiotypeChargedAtomType(DuMM::ChargedAtomTypeIndex chargedAtomTypeIndex, BiotypeIndex biotypeIx)SimTK::DuMMForceFieldSubsystem
setBondBendGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setBondStretchGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setBondTorsionGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setChargedAtomTypeCharge(DuMM::ChargedAtomTypeIndex, Real charge)SimTK::DuMMForceFieldSubsystem [protected]
setChargedAtomTypeCharge_KA(DuMM::ChargedAtomTypeIndex chargedAtomTypeIx, Real charge)SimTK::DuMMForceFieldSubsystem [inline, protected]
setCoulomb12ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCoulomb13ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCoulomb14ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCoulomb15ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCoulombGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCustomBondBendGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCustomBondStretchGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setCustomBondTorsionGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setGbsaGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setGbsaIncludeAceApproximation(bool)SimTK::DuMMForceFieldSubsystem
setGbsaIncludeAceApproximationOff()SimTK::DuMMForceFieldSubsystem [inline]
setGbsaIncludeAceApproximationOn()SimTK::DuMMForceFieldSubsystem [inline]
setNumThreadsRequested(int)SimTK::DuMMForceFieldSubsystem
setQ(State &s, const Vector &q) const SimTK::Subsystem
setSoluteDielectric(Real)SimTK::DuMMForceFieldSubsystem
setSolventDielectric(Real)SimTK::DuMMForceFieldSubsystem
setSystem(System &, SubsystemIndex)SimTK::Subsystem
setTraceOpenMM(bool shouldTrace)SimTK::DuMMForceFieldSubsystem [inline]
setTracing(bool)SimTK::DuMMForceFieldSubsystem
setU(State &s, const Vector &u) const SimTK::Subsystem
setUseMultithreadedComputation(bool)SimTK::DuMMForceFieldSubsystem
setUseOpenMMAcceleration(bool)SimTK::DuMMForceFieldSubsystem
setVdw12ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setVdw13ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setVdw14ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setVdw15ScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setVdwGlobalScaleFactor(Real)SimTK::DuMMForceFieldSubsystem
setVdwMixingRule(VdwMixingRule)SimTK::DuMMForceFieldSubsystem
setZ(State &s, const Vector &z) const SimTK::Subsystem
SimTK_PIMPL_DOWNCAST(ForceSubsystem, Subsystem)SimTK::ForceSubsystem
Subsystem()SimTK::Subsystem
Subsystem(const Subsystem &)SimTK::Subsystem
Subsystem(Subsystem::Guts *g)SimTK::Subsystem
subsystemTopologyHasBeenRealized() const SimTK::Subsystem
updCacheEntry(const State &, CacheEntryIndex) const SimTK::Subsystem
updDiscreteVariable(State &, DiscreteVariableIndex) const SimTK::Subsystem
updDiscreteVarUpdateValue(const State &s, DiscreteVariableIndex dx) const SimTK::Subsystem
updEventTriggersByStage(const State &, Stage) const SimTK::Subsystem
updMultipliers(const State &) const SimTK::Subsystem
updQ(State &) const SimTK::Subsystem
updQDot(const State &) const SimTK::Subsystem
updQDotDot(const State &) const SimTK::Subsystem
updQErr(const State &) const SimTK::Subsystem
updSubsystemGuts()SimTK::Subsystem
updSystem()SimTK::Subsystem
updU(State &) const SimTK::Subsystem
updUDot(const State &) const SimTK::Subsystem
updUDotErr(const State &) const SimTK::Subsystem
updUErr(const State &) const SimTK::Subsystem
updZ(State &) const SimTK::Subsystem
updZDot(const State &) const SimTK::Subsystem
VdwMixingRule enum nameSimTK::DuMMForceFieldSubsystem
WaldmanHagler enum valueSimTK::DuMMForceFieldSubsystem
~Subsystem()SimTK::Subsystem
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