1 | /*
|
---|
2 | * Project: MoleCuilder
|
---|
3 | * Description: creates and alters molecular systems
|
---|
4 | * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
|
---|
5 | * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
|
---|
6 | */
|
---|
7 |
|
---|
8 | /*
|
---|
9 | * CreateAdjacencyAction.cpp
|
---|
10 | *
|
---|
11 | * Created on: May 9, 2010
|
---|
12 | * Author: heber
|
---|
13 | */
|
---|
14 |
|
---|
15 | // include config.h
|
---|
16 | #ifdef HAVE_CONFIG_H
|
---|
17 | #include <config.h>
|
---|
18 | #endif
|
---|
19 |
|
---|
20 | #include "CodePatterns/MemDebug.hpp"
|
---|
21 |
|
---|
22 | #include "CodePatterns/Log.hpp"
|
---|
23 |
|
---|
24 | #include "Descriptors/AtomSelectionDescriptor.hpp"
|
---|
25 | #include "Graph/BondGraph.hpp"
|
---|
26 | #include "molecule.hpp"
|
---|
27 | #include "World.hpp"
|
---|
28 |
|
---|
29 | #include <iostream>
|
---|
30 | #include <list>
|
---|
31 | #include <string>
|
---|
32 |
|
---|
33 | #include "Actions/GraphAction/CreateAdjacencyAction.hpp"
|
---|
34 |
|
---|
35 | using namespace MoleCuilder;
|
---|
36 |
|
---|
37 | // and construct the stuff
|
---|
38 | #include "CreateAdjacencyAction.def"
|
---|
39 | #include "Action_impl_pre.hpp"
|
---|
40 | /** =========== define the function ====================== */
|
---|
41 | Action::state_ptr GraphCreateAdjacencyAction::performCall() {
|
---|
42 | // obtain information
|
---|
43 | getParametersfromValueStorage();
|
---|
44 |
|
---|
45 | BondGraph *BG = World::getInstance().getBondGraph();
|
---|
46 | ASSERT(BG != NULL, "GraphCreateAdjacencyAction: BondGraph is NULL.");
|
---|
47 |
|
---|
48 | World::AtomComposite Set = World::getInstance().getAllAtoms(AtomsBySelection());
|
---|
49 | BG->CreateAdjacency(Set);
|
---|
50 |
|
---|
51 | size_t BondCount = 0;
|
---|
52 | std::vector<molecule *> molecules = World::getInstance().getAllMolecules();
|
---|
53 | for (std::vector<molecule *>::const_iterator iter = molecules.begin();
|
---|
54 | iter != molecules.end(); ++iter)
|
---|
55 | BondCount += (*iter)->getBondCount();
|
---|
56 | LOG(0, "STATUS: Recognized " << BondCount << " bonds.");
|
---|
57 |
|
---|
58 | return Action::success;
|
---|
59 | }
|
---|
60 |
|
---|
61 | Action::state_ptr GraphCreateAdjacencyAction::performUndo(Action::state_ptr _state) {
|
---|
62 | // GraphCreateAdjacencyState *state = assert_cast<GraphCreateAdjacencyState*>(_state.get());
|
---|
63 |
|
---|
64 | return Action::success;
|
---|
65 | }
|
---|
66 |
|
---|
67 | Action::state_ptr GraphCreateAdjacencyAction::performRedo(Action::state_ptr _state){
|
---|
68 | return Action::success;
|
---|
69 | }
|
---|
70 |
|
---|
71 | bool GraphCreateAdjacencyAction::canUndo() {
|
---|
72 | return false;
|
---|
73 | }
|
---|
74 |
|
---|
75 | bool GraphCreateAdjacencyAction::shouldUndo() {
|
---|
76 | return false;
|
---|
77 | }
|
---|
78 | /** =========== end of function ====================== */
|
---|