| bis | ErgoMolInfo | [private] |
| ErgoMolInfo(const BasisInfoStruct &bis_, const Molecule &mol) | ErgoMolInfo | |
| getAtom(int icent, int *cnt, real(*coor)[3], int *charge, int *mult) const | ErgoMolInfo | [virtual] |
| getBlocks(const real *center, real cellsz, const real *rshell, int *nblcnt, int(*iblcks)[2]) const | ErgoMolInfo | [virtual] |
| getBlocks1(const real *center, real cellsz, const real *rshell, int *nblcnt, int(*iblcks)[2]) const | ErgoMolInfo | |
| getExps(int *maxl, int **nucbas, real(**aa)[2]) const | ErgoMolInfo | [virtual] |
| GridGenMolInfo(int a, int b, int s) | GridGenMolInfo | [inline] |
| molecule | ErgoMolInfo | [private] |
| noOfAtoms | GridGenMolInfo | |
| noOfBasisFuncs | GridGenMolInfo | |
| noOfShells | GridGenMolInfo | |
| setShellRadii(real *shellRadii) const | ErgoMolInfo | [virtual] |
| shellTree | ErgoMolInfo | |
| ~ErgoMolInfo() | ErgoMolInfo | [virtual] |
| ~GridGenMolInfo() | GridGenMolInfo | [inline, virtual] |
