| 1 | /*
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| 2 | * Project: MoleCuilder
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| 3 | * Description: creates and alters molecular systems
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| 4 | * Copyright (C) 2010 University of Bonn. All rights reserved.
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| 5 | * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
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| 6 | */
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| 7 |
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| 8 | /*
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| 9 | * BondLengthTableAction.cpp
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| 10 | *
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| 11 | * Created on: May 9, 2010
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| 12 | * Author: heber
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| 13 | */
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| 14 |
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| 15 | // include config.h
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| 16 | #ifdef HAVE_CONFIG_H
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| 17 | #include <config.h>
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| 18 | #endif
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| 19 |
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| 20 | #include "Helpers/MemDebug.hpp"
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| 21 |
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| 22 | #include "bondgraph.hpp"
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| 23 | #include "config.hpp"
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| 24 | #include "Helpers/Log.hpp"
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| 25 | #include "Helpers/Verbose.hpp"
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| 26 | #include "World.hpp"
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| 27 |
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| 28 | #include <iostream>
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| 29 | #include <string>
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| 30 |
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| 31 | using namespace std;
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| 32 |
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| 33 | #include "Actions/CommandAction/BondLengthTableAction.hpp"
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| 34 |
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| 35 | // and construct the stuff
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| 36 | #include "BondLengthTableAction.def"
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| 37 | #include "Action_impl_pre.hpp"
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| 38 | /** =========== define the function ====================== */
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| 39 | Action::state_ptr CommandBondLengthTableAction::performCall() {
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| 40 | ostringstream usage;
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| 41 |
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| 42 | // obtain information
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| 43 | getParametersfromValueStorage();
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| 44 |
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| 45 | DoLog(0) && (Log() << Verbose(0) << "Using " << params.BondGraphFileName << " as bond length table." << endl);
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| 46 | config *configuration = World::getInstance().getConfig();
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| 47 | if (configuration->BG == NULL) {
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| 48 | configuration->BG = new BondGraph(configuration->GetIsAngstroem());
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| 49 | if ((!params.BondGraphFileName.empty())
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| 50 | && boost::filesystem::exists(params.BondGraphFileName)
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| 51 | && (configuration->BG->LoadBondLengthTable(params.BondGraphFileName.string()))) {
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| 52 | DoLog(0) && (Log() << Verbose(0) << "Bond length table loaded successfully." << endl);
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| 53 | return Action::success;
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| 54 | } else {
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| 55 | DoeLog(1) && (eLog()<< Verbose(1) << "Bond length table loading failed." << endl);
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| 56 | return Action::failure;
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| 57 | }
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| 58 | } else {
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| 59 | DoLog(0) && (Log() << Verbose(0) << "Bond length table already present." << endl);
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| 60 | return Action::failure;
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| 61 | }
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| 62 | }
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| 63 |
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| 64 | Action::state_ptr CommandBondLengthTableAction::performUndo(Action::state_ptr _state) {
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| 65 | // ParserLoadXyzState *state = assert_cast<ParserLoadXyzState*>(_state.get());
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| 66 |
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| 67 | return Action::failure;
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| 68 | // string newName = state->mol->getName();
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| 69 | // state->mol->setName(state->lastName);
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| 70 | //
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| 71 | // return Action::state_ptr(new ParserLoadXyzState(state->mol,newName));
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| 72 | }
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| 73 |
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| 74 | Action::state_ptr CommandBondLengthTableAction::performRedo(Action::state_ptr _state){
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| 75 | return Action::failure;
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| 76 | }
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| 77 |
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| 78 | bool CommandBondLengthTableAction::canUndo() {
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| 79 | return false;
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| 80 | }
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| 81 |
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| 82 | bool CommandBondLengthTableAction::shouldUndo() {
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| 83 | return false;
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| 84 | }
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| 85 | /** =========== end of function ====================== */
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