Action_Thermostats
Add_AtomRandomPerturbation
Add_FitFragmentPartialChargesAction
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Added_ParseSaveFragmentResults
AddingActions_SaveParseParticleParameters
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_ParticleName_to_Atom
Adding_StructOpt_integration_tests
AtomFragments
Automaking_mpqc_open
AutomationFragmentation_failures
Candidate_v1.5.4
Candidate_v1.6.0
Candidate_v1.6.1
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
CombiningParticlePotentialParsing
Combining_Subpackages
Debian_Package_split
Debian_package_split_molecuildergui_only
Disabling_MemDebug
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph
EmpiricalPotential_contain_HomologyGraph_documentation
Enable_parallel_make_install
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
FitPartialCharges_GlobalError
Fix_BoundInBox_CenterInBox_MoleculeActions
Fix_ChargeSampling_PBC
Fix_ChronosMutex
Fix_FitPartialCharges
Fix_FitPotential_needs_atomicnumbers
Fix_ForceAnnealing
Fix_IndependentFragmentGrids
Fix_ParseParticles
Fix_ParseParticles_split_forward_backward_Actions
Fix_PopActions
Fix_QtFragmentList_sorted_selection
Fix_Restrictedkeyset_FragmentMolecule
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
Fix_fitting_potentials
Fixes
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
FragmentAction_writes_AtomFragments
FragmentMolecule_checks_bonddegrees
GeometryObjects
Gui_Fixes
Gui_displays_atomic_force_velocity
ImplicitCharges
IndependentFragmentGrids
IndependentFragmentGrids_IndividualZeroInstances
IndependentFragmentGrids_IntegrationTest
IndependentFragmentGrids_Sole_NN_Calculation
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
JobMarket_unresolvable_hostname_fix
MoreRobust_FragmentAutomation
ODR_violation_mpqc_open
PartialCharges_OrthogonalSummation
PdbParser_setsAtomName
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
Rewrite_FitPartialCharges
RotateToPrincipalAxisSystem_UndoRedo
SaturateAtoms_findBestMatching
SaturateAtoms_singleDegree
StoppableMakroAction
Subpackage_CodePatterns
Subpackage_JobMarket
Subpackage_LinearAlgebra
Subpackage_levmar
Subpackage_mpqc_open
Subpackage_vmg
Switchable_LogView
ThirdParty_MPQC_rebuilt_buildsystem
TrajectoryDependenant_MaxOrder
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
TremoloParser_setsAtomName
Ubuntu_1604_changes
stable
Last change
on this file since 16227a was 94d5ac6, checked in by Frederik Heber <heber@…>, 12 years ago |
FIX: As we use GSL internally, we are as of now required to use GPL v2 license.
- GNU Scientific Library is used at every place in the code, especially the
sub-package LinearAlgebra is based on it which in turn is used really
everywhere in the remainder of MoleCuilder. Hence, we have to use the
GPL license for the whole of MoleCuilder. In effect, GPL's COPYING was
present all along and stated the terms of the GPL v2 license.
- Hence, I added the default GPL v2 disclaimer to every source file and removed
the note about a (actually missing) LICENSE file.
- also, I added a help-redistribute action which again gives the disclaimer of
the GPL v2.
- also, I changed in the disclaimer that is printed at every program start in
builder_init.cpp.
- TEST: Added check on GPL statement present in every module to test CodeChecks
project-disclaimer.
|
-
Property mode
set to
100644
|
File size:
1.8 KB
|
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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) 2010-2012 University of Bonn. All rights reserved.
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5 | *
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6 | *
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7 | * This file is part of MoleCuilder.
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8 | *
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9 | * MoleCuilder is free software: you can redistribute it and/or modify
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10 | * it under the terms of the GNU General Public License as published by
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11 | * the Free Software Foundation, either version 2 of the License, or
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12 | * (at your option) any later version.
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13 | *
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14 | * MoleCuilder is distributed in the hope that it will be useful,
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15 | * but WITHOUT ANY WARRANTY; without even the implied warranty of
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16 | * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
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17 | * GNU General Public License for more details.
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18 | *
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19 | * You should have received a copy of the GNU General Public License
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20 | * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
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21 | */
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22 |
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23 | /** \file config.cpp
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24 | *
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25 | * Function implementations for the class config.
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26 | *
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27 | */
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28 |
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29 | // include config.h
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30 | #ifdef HAVE_CONFIG_H
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31 | #include <config.h>
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32 | #endif
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33 |
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34 | #include "CodePatterns/MemDebug.hpp"
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35 |
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36 | #include <cstring>
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37 |
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38 | #include "config.hpp"
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39 |
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40 | #include "Helpers/defs.hpp"
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41 |
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42 | /************************************* Functions for class config ***************************/
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43 |
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44 | /** Constructor for config file class.
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45 | */
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46 | config::config() :
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47 | databasepath(NULL),
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48 | defaultpath(NULL),
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49 | FastParsing(false),
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50 | IsAngstroem(1),
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51 | Deltat(0.01)
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52 | {
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53 | defaultpath = new char[MAXSTRINGSIZE];
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54 | databasepath = new char[MAXSTRINGSIZE];
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55 | strncpy(defaultpath,"not specified", MAXSTRINGSIZE);
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56 | };
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57 |
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58 | /** Destructor for config file class.
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59 | */
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60 | config::~config()
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61 | {
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62 | delete[](defaultpath);
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63 | delete[](databasepath);
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64 | };
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65 |
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66 | /** Returns private config::IsAngstroem.
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67 | * \return IsAngstroem
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68 | */
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69 | bool config::GetIsAngstroem() const
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70 | {
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71 | return (IsAngstroem == 1);
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72 | };
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73 |
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