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        Add_AtomRandomPerturbation
        Add_FitFragmentPartialChargesAction
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        Added_ParseSaveFragmentResults
        AddingActions_SaveParseParticleParameters
        Adding_Graph_to_ChangeBondActions
        Adding_MD_integration_tests
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        AtomFragments
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        EmpiricalPotential_contain_HomologyGraph_documentation
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        Enhanced_StructuralOptimization_continued
        Example_ManyWaysToTranslateAtom
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        FitPartialCharges_GlobalError
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        Fix_ChargeSampling_PBC
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        Fix_FitPotential_needs_atomicnumbers
        Fix_ForceAnnealing
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        Fix_ParseParticles
        Fix_ParseParticles_split_forward_backward_Actions
        Fix_PopActions
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        Fixes
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        ForceAnnealing_with_BondGraph_continued
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        FragmentAction_writes_AtomFragments
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        GeometryObjects
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        JobMarket_unresolvable_hostname_fix
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        ODR_violation_mpqc_open
        PartialCharges_OrthogonalSummation
        PdbParser_setsAtomName
        PythonUI_with_named_parameters
        QtGui_reactivate_TimeChanged_changes
        Recreated_GuiChecks
        Rewrite_FitPartialCharges
        RotateToPrincipalAxisSystem_UndoRedo
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        StoppableMakroAction
        Subpackage_CodePatterns
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        Switchable_LogView
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        TrajectoryDependenant_MaxOrder
        TremoloParser_IncreasedPrecision
        TremoloParser_MultipleTimesteps
        TremoloParser_setsAtomName
        Ubuntu_1604_changes
        stable
      
      
        
          | 
            Last change
 on this file since 38e075 was             86cff86, checked in by Frederik Heber <heber@…>, 15 years ago           | 
        
        
          | 
             
InputAction now parses all possible formats, not only pcp. 
 
- new function FormatParserStorage::get() that checks on the suffix and calls the load() function of the respective specialized FormatParser.
 - InputAction changed such that ...
- prefix and suffix are extracted.
 - FormatParserStorage::get() is used.
 - empty configs are handled, too.
 
  - FormatParserStorage::ParserSuffix changed, removed ".conf".
 - TESTFIX: renamed all files to diff accordingly: .conf.xyz -> .xyz, .conf.in -> .in
 - BUGFIX: xyz files were written without initial tab in front of comment, fix in ParserUnitTest necessary (i.e. a tab was missing there as we always write it now)
 - ChangeElementAction: now needs --atom-by-id and takes the element as argument
  
           | 
        
        
          
            
              - 
Property                 mode
 set to                 
100644
               
             
           | 
        
        
          | 
            File size:
            1.5 KB
           | 
        
      
      
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| 1 | /** \file FormatParserStorage.hpp
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| 2 |  *
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| 3 |  *  date: Jun, 22 2010
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| 4 |  *  author: heber
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| 5 |  *
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| 6 |  */
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| 7 | 
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| 8 | #ifndef FORMATPARSERSTORAGE_HPP_
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| 9 | #define FORMATPARSERSTORAGE_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 "Patterns/Singleton.hpp"
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| 17 | 
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| 18 | #include <string>
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| 19 | #include <vector>
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| 20 | 
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| 21 | class FormatParser;
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| 22 | class MpqcParser;
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| 23 | class PcpParser;
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| 24 | class TremoloParser;
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| 25 | class XyzParser;
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| 26 | 
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| 27 | // enum has to be outside of class for operator++ to be possible
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| 28 | enum ParserTypes { mpqc, pcp, tremolo, xyz, ParserTypes_end, ParserTypes_begin = mpqc };
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| 29 | typedef enum ParserTypes ParserTypes;
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| 30 | 
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| 31 | ParserTypes &operator++(ParserTypes &type);
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| 32 | 
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| 33 | class FormatParserStorage : public Singleton<FormatParserStorage> {
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| 34 |   friend class Singleton<FormatParserStorage>;
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| 35 | public:
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| 36 | 
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| 37 | 
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| 38 |   void addMpqc();
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| 39 |   void addPcp();
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| 40 |   void addTremolo();
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| 41 |   void addXyz();
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| 42 | 
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| 43 |   bool get(std::istream &input, std::string suffix);
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| 44 |   MpqcParser &getMpqc();
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| 45 |   PcpParser &getPcp();
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| 46 |   TremoloParser &getTremolo();
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| 47 |   XyzParser &getXyz();
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| 48 | 
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| 49 |   void SetOutputPrefixForAll(std::string &_prefix);
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| 50 |   void SaveAll();
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| 51 | 
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| 52 | private:
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| 53 |   // private constructors as this is a singleton
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| 54 |   FormatParserStorage();
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| 55 |   ~FormatParserStorage();
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| 56 |   
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| 57 |   // list of allocated parsers
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| 58 |   std::vector<FormatParser *> ParserList;
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| 59 | 
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| 60 |   // list of allocated strams
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| 61 |   std::vector<std::ofstream *> ParserStream;
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| 62 | 
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| 63 |   // which parser is already present
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| 64 |   std::vector<bool> ParserPresent;
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| 65 | 
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| 66 |   // default suffix of each parser type
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| 67 |   std::vector<std::string> ParserSuffix;
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| 68 | 
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| 69 |   // prefix of the filenames to use on save
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| 70 |   std::string prefix;
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| 71 | };
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| 72 | 
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| 73 | #endif // FORMATPARSERSTORAGE_HPP_
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