Action_Thermostats
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
ChemicalSpaceEvaluator
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
Fix_Verbose_Codepatterns
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
Gui_displays_atomic_force_velocity
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
PythonUI_with_named_parameters
Recreated_GuiChecks
StoppableMakroAction
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Last change
on this file since 0e894a was 41a467, checked in by Frederik Heber <heber@…>, 13 years ago |
LARGE: config class is now just a tiny container.
- this was loooooobg overdue. Config.cpp contained remnants from parsing pcp
files and much else. Also fragmentation depended on it. Since refactoring
of MoleculeListClass and the fragmentation, we don't need it anymore.
- helper functions ParseForParameters(), LoadMolecule() extracted into new
module PcpParser_helper.
- config class now just contains 4 variables that are generally required
(especially IsAngstroem) and they should probably remain with the world.
- removed some places where config.hpp was no unnecessarily included.
- Moved ConfigFileBuffer.* over to subfolder src/Parser/ where it rather
belongs (associated with PcpParser).
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File size:
931 bytes
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Rev | Line | |
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[41a467] | 1 | /*
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| 2 | * PcpParser_helper.hpp
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| 3 | *
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| 4 | * Created on: Oct 27, 2011
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef PCPPARSER_HELPER_HPP_
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| 9 | #define PCPPARSER_HELPER_HPP_
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| 10 |
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| 11 | // include config.h
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| 12 | #ifdef HAVE_CONFIG_H
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| 13 | #include <config.h>
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| 14 | #endif
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| 15 |
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| 16 | #include <string>
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| 17 |
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| 18 | class ConfigFileBuffer;
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| 19 | class molecule;
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| 20 | class periodentafel;
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| 21 |
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| 22 | int ParseForParameter(const int verbose, ifstream * const file, const char * const name, const int sequential, const int xth, const int yth, const int type, void * value, const int repetition, const int critical);
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| 23 | int ParseForParameter(const int verbose, struct ConfigFileBuffer * const FileBuffer, const char * const name, const int sequential, const int xth, const int yth, const int type, void * value, const int repetition, const int critical);
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| 24 | void LoadMolecule(molecule * const &mol, struct ConfigFileBuffer * const &FileBuffer, const periodentafel * const periode, const bool FastParsing);
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| 25 |
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| 26 |
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| 27 | #endif /* PCPPARSER_HELPER_HPP_ */
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