BALL::SolventPredicate Class Reference
Predicate indicating solvent atoms. More...#include <standardPredicates.h>
Inheritance diagram for BALL::SolventPredicate:
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Public Member Functions |
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| virtual bool | operator() (const Atom &atom) const |
Evaluate the predicate for the atom
atom. |
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Detailed Description
Predicate indicating solvent atoms.Returns true, if the atom belongs to a solvent
molecule. This predicate is true if the atom is
contained in a molecule with the property Molecule::IS_SOLVENT set. This is usually the case for
solvents added automatically by a force field.
- See also:
- PeriodicBoundary::addSolvent
Member Function Documentation
| virtual bool BALL::SolventPredicate::operator() | ( | const Atom & | atom | ) | const [virtual] |
Evaluate the predicate for the atom
atom.
- Parameters:
-
atom the atom to test
- Returns:
- true, if the predicate is true, false otherwise
Reimplemented from BALL::ExpressionPredicate.
