Action_Thermostats
Add_AtomRandomPerturbation
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
Automaking_mpqc_open
AutomationFragmentation_failures
Candidate_v1.6.0
Candidate_v1.6.1
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
Combining_Subpackages
Debian_Package_split
Debian_package_split_molecuildergui_only
Disabling_MemDebug
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enable_parallel_make_install
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
FitPartialCharges_GlobalError
Fix_ChronosMutex
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
GeometryObjects
Gui_displays_atomic_force_velocity
IndependentFragmentGrids_IntegrationTest
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
JobMarket_unresolvable_hostname_fix
ODR_violation_mpqc_open
PartialCharges_OrthogonalSummation
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
RotateToPrincipalAxisSystem_UndoRedo
StoppableMakroAction
Subpackage_levmar
Subpackage_vmg
ThirdParty_MPQC_rebuilt_buildsystem
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Ubuntu_1604_changes
stable
|
Last change
on this file since 4464ef was 97445f, checked in by Frederik Heber <heber@…>, 9 years ago |
|
World::getMolecules..() now has const versions as well.
|
-
Property mode
set to
100644
|
|
File size:
528 bytes
|
| Line | |
|---|
| 1 | #ifndef MOLECULENAMEDESCRIPTOR_IMPL_HPP
|
|---|
| 2 | #define MOLECULENAMEDESCRIPTOR_IMPL_HPP
|
|---|
| 3 |
|
|---|
| 4 | // include config.h
|
|---|
| 5 | #ifdef HAVE_CONFIG_H
|
|---|
| 6 | #include <config.h>
|
|---|
| 7 | #endif
|
|---|
| 8 |
|
|---|
| 9 |
|
|---|
| 10 | #include "Descriptors/MoleculeDescriptor_impl.hpp"
|
|---|
| 11 |
|
|---|
| 12 | class MoleculeNameDescriptor_impl : public MoleculeDescriptor_impl
|
|---|
| 13 | {
|
|---|
| 14 | public:
|
|---|
| 15 | MoleculeNameDescriptor_impl(std::string _name);
|
|---|
| 16 | virtual ~MoleculeNameDescriptor_impl();
|
|---|
| 17 |
|
|---|
| 18 | bool predicate(const std::pair<moleculeId_t,const molecule*> molecule) const;
|
|---|
| 19 |
|
|---|
| 20 | private:
|
|---|
| 21 | std::string name;
|
|---|
| 22 | };
|
|---|
| 23 |
|
|---|
| 24 | #endif //MOLECULENAMEDESCRIPTOR_IMPL_HPP
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
