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NAMD
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This is the complete list of members for GromacsTopFile, including all inherited members.
| getAngle(int num, int *atomi, int *atomj, int *atomk, int *angletype) const | GromacsTopFile | |
| getAngleParams(int num, Real *th0, Real *kth, int *funct) const | GromacsTopFile | |
| getAtom(int num, int *residue_number, char *residue_name, char *atom_name, char *atom_type, int *atom_typenum, Real *charge, Real *mass) const | GromacsTopFile | |
| getAtomParams(int num, char *type) const | GromacsTopFile | inline |
| getBond(int num, int *atomi, int *atomj, int *bondtype) const | GromacsTopFile | |
| getBondParams(int num, Real *b0, Real *kB, int *funct) const | GromacsTopFile | |
| getDihedral(int num, int *atomi, int *atomj, int *atomk, int *atoml, int *type) const | GromacsTopFile | |
| getDihedralParams(int num, Real *c, int *mult, int *funct) const | GromacsTopFile | |
| getExclusions(int *, int *) const | GromacsTopFile | |
| getNumAngleParams() const | GromacsTopFile | inline |
| getNumAngles() const | GromacsTopFile | |
| getNumAtomParams() const | GromacsTopFile | inline |
| getNumAtoms() const | GromacsTopFile | |
| getNumBondParams() const | GromacsTopFile | inline |
| getNumBonds() const | GromacsTopFile | |
| getNumDihedralParams() const | GromacsTopFile | inline |
| getNumDihedrals() const | GromacsTopFile | |
| getNumExclusions() const | GromacsTopFile | |
| getNumGaussPair() const | GromacsTopFile | |
| getNumLJPair() const | GromacsTopFile | |
| getNumPair() const | GromacsTopFile | |
| getPairGaussArrays2(int *indexA, int *indexB, Real *gaussA, Real *gaussMu1, Real *gaussSigma1, Real *gaussMu2, Real *gaussSigma2, Real *gaussRepulsive) | GromacsTopFile | |
| getPairLJArrays2(int *indexA, int *indexB, Real *pairC6, Real *pairC12) | GromacsTopFile | |
| getSystemName() const | GromacsTopFile | inline |
| getVDWParams(int typea, int typeb, Real *c6, Real *c12, Real *c6pair, Real *c7) const | GromacsTopFile | |
| GromacsTopFile(char *filename) | GromacsTopFile |
1.8.5