source: src/Actions/SelectionAction/Molecules/InvertMoleculesAction.hpp@ bd0159

ForceAnnealing_oldresults
Last change on this file since bd0159 was ebc499, checked in by Frederik Heber <heber@…>, 13 years ago

Added InvertMoleculesAction and InvertAtomsAction.

  • World has two new functions invertAtomSelection() and ..MoleculeSelection().
  • these actions are needed to get some of the boolean operations working that are possible inside the code but not outside. Concatenated selections are on the command-line always combined as OR and never as AND, via an invertion operation, we may combine these into an effective AND combination.
  • also added regression tests Selection/Atoms/InvertAtoms and Selection/ Molecules/InvertMolecules.
  • Property mode set to 100644
File size: 379 bytes
Line 
1/*
2 * InvertMoleculesAction.hpp
3 *
4 * Created on: Mar 12, 2012
5 * Author: heber
6 */
7
8#ifndef INVERTMOLECULESSACTION_HPP_
9#define INVERTMOLECULESSACTION_HPP_
10
11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16
17
18#include "Actions/Action.hpp"
19
20#include "InvertMoleculesAction.def"
21#include "Action_impl_header.hpp"
22
23#endif /* INVERTMOLECULESSACTION_HPP_ */
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