- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
src/Fragmentation/Exporters/SaturatedBond.cpp
r6c30ab rbac32f 64 64 saturated_atom.getElement().getHBondDistance(saturated_bond.getDegree()-1); 65 65 ASSERT( HydrogenDistance > 0., 66 "SaturatedBond::SaturatedBond() - negative bond distance for " 67 +saturated_atom.getElement().getName()); 66 "SaturatedBond::SaturatedBond() - negative bond distance"); 68 67 const double HydrogenAngle = 69 68 saturated_atom.getElement().getHBondAngle(saturated_bond.getDegree()-1); 70 69 ASSERT( HydrogenAngle >= 0., 71 "SaturatedBond::SaturatedBond() - negative bond angle for " 72 +saturated_atom.getElement().getName()); 70 "SaturatedBond::SaturatedBond() - negative bond angle"); 73 71 LOG(5, "DEBUG: Hydrogen distance is " << HydrogenDistance 74 72 << ", angle is " << HydrogenAngle);
Note:
See TracChangeset
for help on using the changeset viewer.