 |
 |
 | OEChem - API Manual
Version 1.3.1 | ||||
 |
 |
 |
 |
||||
|
|
| OEChem - API Manual
Version 1.3.1 | ||||
|
|
|
|
||||
OEPartPred(unsigned int *parts, unsigned int size)
Constructs the functor where the parts are specifeid by itegers in the
integer array passed in as parts, and the number of parts is
specified by size. The parts array is assumed to be of length
mol.GetMaxAtomIdx(), where parts[atom->GetIdx()] is the
integer associated with the part to which atom belongs.
|
|
| OEChem - API Manual
Version 1.3.1 | ||||
|
|
|
|
||||