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Geant4/processes/electromagnetic/dna/utils/src/G4DNACrossSectionDataSet.cc

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Diff markup

Differences between /processes/electromagnetic/dna/utils/src/G4DNACrossSectionDataSet.cc (Version 11.3.0) and /processes/electromagnetic/dna/utils/src/G4DNACrossSectionDataSet.cc (Version 5.1.p1)


  1 //                                                  1 
  2 // *******************************************    
  3 // * License and Disclaimer                       
  4 // *                                              
  5 // * The  Geant4 software  is  copyright of th    
  6 // * the Geant4 Collaboration.  It is provided    
  7 // * conditions of the Geant4 Software License    
  8 // * LICENSE and available at  http://cern.ch/    
  9 // * include a list of copyright holders.         
 10 // *                                              
 11 // * Neither the authors of this software syst    
 12 // * institutes,nor the agencies providing fin    
 13 // * work  make  any representation or  warran    
 14 // * regarding  this  software system or assum    
 15 // * use.  Please see the license in the file     
 16 // * for the full disclaimer and the limitatio    
 17 // *                                              
 18 // * This  code  implementation is the result     
 19 // * technical work of the GEANT4 collaboratio    
 20 // * By using,  copying,  modifying or  distri    
 21 // * any work based  on the software)  you  ag    
 22 // * use  in  resulting  scientific  publicati    
 23 // * acceptance of all terms of the Geant4 Sof    
 24 // *******************************************    
 25 //                                                
 26 //                                                
 27                                                   
 28 //                                                
 29 // Author: Riccardo Capra <capra@ge.infn.it>      
 30 // Code review by MGP October 2007: removed in    
 31 //                                  more impro    
 32 //                                                
 33 // History:                                       
 34 // -----------                                    
 35 // 30 Jun 2005  RC           Created              
 36 // 14 Oct 2007  MGP          Removed inheritan    
 37 //                                                
 38 // 15 Jul 2009   N.A.Karakatsanis                 
 39 //                                                
 40 //                           - LoadNonLogData     
 41 //                             dataset. It is     
 42 //                                                
 43 //                           - LoadData method    
 44 //                             It retrieves th    
 45 //                             respective log     
 46 //                                                
 47 //                           - SetLogEnergiesD    
 48 //                             The EM data set    
 49 //                             These initializ    
 50 //                             operations         
 51 //                                                
 52 //                                                
 53 // -------------------------------------------    
 54                                                   
 55                                                   
 56 #include "G4DNACrossSectionDataSet.hh"            
 57 #include "G4VDataSetAlgorithm.hh"                 
 58 #include "G4EMDataSet.hh"                         
 59 #include <vector>                                 
 60 #include <fstream>                                
 61 #include <sstream>                                
 62                                                   
 63                                                   
 64 G4DNACrossSectionDataSet::G4DNACrossSectionDat    
 65                G4double argUnitEnergies,          
 66                G4double argUnitData)              
 67   :                                               
 68    algorithm(argAlgorithm), unitEnergies(argUn    
 69 {                                                 
 70   z = 0;                                          
 71                                                   
 72 }                                                 
 73                                                   
 74                                                   
 75 G4DNACrossSectionDataSet::~G4DNACrossSectionDa    
 76 {                                                 
 77   CleanUpComponents();                            
 78                                                   
 79                                                   
 80     delete algorithm;                             
 81 }                                                 
 82                                                   
 83 G4bool G4DNACrossSectionDataSet::LoadData(cons    
 84 {                                                 
 85   CleanUpComponents();                            
 86                                                   
 87   G4String fullFileName(FullFileName(argFileNa    
 88   std::ifstream in(fullFileName, std::ifstream    
 89                                                   
 90   if (!in.is_open())                              
 91     {                                             
 92       G4String message("Data file \"");           
 93       message+=fullFileName;                      
 94       message+="\" not found";                    
 95       G4Exception("G4DNACrossSectionDataSet::L    
 96                       FatalException,message);    
 97       return false;                               
 98     }                                             
 99                                                   
100   std::vector<G4DataVector *> columns;            
101   std::vector<G4DataVector *> log_columns;        
102                                                   
103   auto stream(new std::stringstream);             
104   char c;                                         
105   G4bool comment(false);                          
106   G4bool space(true);                             
107   G4bool first(true);                             
108                                                   
109   try                                             
110     {                                             
111       while (!in.eof())                           
112   {                                               
113     in.get(c);                                    
114                                                   
115     switch (c)                                    
116       {                                           
117       case '\r':                                  
118       case '\n':                                  
119         if (!first)                               
120     {                                             
121       unsigned long i(0);                         
122       G4double value;                             
123                                                   
124       while (!stream->eof())                      
125         {                                         
126           (*stream) >> value;                     
127                                                   
128           while (i>=columns.size())               
129                         {                         
130        columns.push_back(new G4DataVector);       
131                          log_columns.push_back    
132                         }                         
133                                                   
134           columns[i]->push_back(value);           
135                                                   
136 // N. A. Karakatsanis                             
137 // A condition is applied to check if negative    
138 // If yes, then a near-zero value is applied t    
139 // If a value is zero, this simplification is     
140 // If a value is negative, then it is not acce    
141 // logarithmic values should not be used by in    
142 //                                                
143 // Therefore, G4LogLogInterpolation and G4LinL    
144 // Instead, G4LinInterpolation is safe in ever    
145 // SemiLogInterpolation is safe only if the en    
146 // G4LinLogInterpolation is safe only if the c    
147                                                   
148                       if (value <=0.) value =     
149                       log_columns[i]->push_bac    
150                                                   
151           i++;                                    
152         }                                         
153                                                   
154       delete stream;                              
155       stream=new std::stringstream;               
156     }                                             
157                                                   
158         first=true;                               
159         comment=false;                            
160         space=true;                               
161         break;                                    
162                                                   
163       case '#':                                   
164         comment=true;                             
165         break;                                    
166                                                   
167       case '\t':                                  
168       case ' ':                                   
169         space = true;                             
170               break;                              
171                                                   
172       default:                                    
173         if (comment) { break; }                   
174         if (space && (!first)) { (*stream) <<     
175                                                   
176         first=false;                              
177         (*stream) << c;                           
178         space=false;                              
179       }                                           
180   }                                               
181     }                                             
182   catch(const std::ios::failure &e)               
183     {                                             
184       // some implementations of STL could thr    
185       // when read wants read characters after    
186     }                                             
187                                                   
188   delete stream;                                  
189                                                   
190   std::size_t maxI(columns.size());               
191                                                   
192   if (maxI<2)                                     
193     {                                             
194       G4String message("Data file \"");           
195       message+=fullFileName;                      
196       message+="\" should have at least two co    
197       G4Exception("G4DNACrossSectionDataSet::L    
198                       FatalException,message);    
199       return false;                               
200     }                                             
201                                                   
202   std::size_t i(1);                               
203   while (i<maxI)                                  
204     {                                             
205       std::size_t maxJ(columns[i]->size());       
206                                                   
207       if (maxJ!=columns[0]->size())               
208   {                                               
209     G4String message("Data file \"");             
210     message+=fullFileName;                        
211     message+="\" has lines with a different nu    
212     G4Exception("G4DNACrossSectionDataSet::Loa    
213                       FatalException,message);    
214     return false;                                 
215   }                                               
216                                                   
217       std::size_t j(0);                           
218                                                   
219       auto argEnergies=new G4DataVector;          
220       auto argData=new G4DataVector;              
221       auto argLogEnergies=new G4DataVector;       
222       auto argLogData=new G4DataVector;           
223                                                   
224       while(j<maxJ)                               
225   {                                               
226     argEnergies->push_back(columns[0]->operato    
227     argData->push_back(columns[i]->operator[]     
228     argLogEnergies->push_back(log_columns[0]->    
229     argLogData->push_back(log_columns[i]->oper    
230     j++;                                          
231   }                                               
232                                                   
233       AddComponent(new G4EMDataSet(G4int(i-1),    
234                                                   
235       i++;                                        
236     }                                             
237                                                   
238   i=maxI;                                         
239   while (i>0)                                     
240     {                                             
241       i--;                                        
242       delete columns[i];                          
243       delete log_columns[i];                      
244     }                                             
245                                                   
246   return true;                                    
247 }                                                 
248                                                   
249                                                   
250 G4bool G4DNACrossSectionDataSet::LoadNonLogDat    
251 {                                                 
252   CleanUpComponents();                            
253                                                   
254   G4String fullFileName(FullFileName(argFileNa    
255   std::ifstream in(fullFileName, std::ifstream    
256                                                   
257   if (!in.is_open())                              
258     {                                             
259       G4String message("Data file \"");           
260       message+=fullFileName;                      
261       message+="\" not found";                    
262       G4Exception("G4DNACrossSectionDataSet::L    
263                       FatalException,message);    
264       return false;                               
265     }                                             
266                                                   
267   std::vector<G4DataVector *> columns;            
268                                                   
269   auto stream(new std::stringstream);             
270   char c;                                         
271   G4bool comment(false);                          
272   G4bool space(true);                             
273   G4bool first(true);                             
274                                                   
275   try                                             
276     {                                             
277       while (!in.eof())                           
278   {                                               
279     in.get(c);                                    
280                                                   
281     switch (c)                                    
282       {                                           
283       case '\r':                                  
284       case '\n':                                  
285         if (!first)                               
286     {                                             
287       unsigned long i(0);                         
288       G4double value;                             
289                                                   
290       while (!stream->eof())                      
291         {                                         
292           (*stream) >> value;                     
293                                                   
294           while (i>=columns.size())               
295                         {                         
296        columns.push_back(new G4DataVector);       
297                         }                         
298                                                   
299           columns[i]->push_back(value);           
300                                                   
301           i++;                                    
302         }                                         
303                                                   
304       delete stream;                              
305       stream=new std::stringstream;               
306     }                                             
307                                                   
308         first=true;                               
309         comment=false;                            
310         space=true;                               
311         break;                                    
312                                                   
313       case '#':                                   
314         comment=true;                             
315         break;                                    
316                                                   
317       case '\t':                                  
318       case ' ':                                   
319         space = true;                             
320               break;                              
321                                                   
322       default:                                    
323         if (comment) { break; }                   
324         if (space && (!first)) { (*stream) <<     
325                                                   
326         first=false;                              
327         (*stream) << c;                           
328         space=false;                              
329       }                                           
330   }                                               
331     }                                             
332   catch(const std::ios::failure &e)               
333     {                                             
334       // some implementations of STL could thr    
335       // when read wants read characters after    
336     }                                             
337                                                   
338   delete stream;                                  
339                                                   
340   std::size_t maxI(columns.size());               
341                                                   
342   if (maxI<2)                                     
343     {                                             
344       G4String message("Data file \"");           
345       message+=fullFileName;                      
346       message+="\" should have at least two co    
347       G4Exception("G4DNACrossSectionDataSet::L    
348                       FatalException,message);    
349       return false;                               
350     }                                             
351                                                   
352   std::size_t i(1);                               
353   while (i<maxI)                                  
354     {                                             
355       std::size_t maxJ(columns[i]->size());       
356                                                   
357       if (maxJ!=columns[0]->size())               
358   {                                               
359     G4String message("Data file \"");             
360     message+=fullFileName;                        
361     message+="\" has lines with a different nu    
362           G4Exception("G4DNACrossSectionDataSe    
363                       FatalException,message);    
364     return false;                                 
365   }                                               
366                                                   
367       std::size_t j(0);                           
368                                                   
369       auto argEnergies=new G4DataVector;          
370       auto argData=new G4DataVector;              
371                                                   
372       while(j<maxJ)                               
373   {                                               
374     argEnergies->push_back(columns[0]->operato    
375     argData->push_back(columns[i]->operator[]     
376     j++;                                          
377   }                                               
378                                                   
379       AddComponent(new G4EMDataSet(G4int(i-1),    
380                                                   
381       i++;                                        
382     }                                             
383                                                   
384   i=maxI;                                         
385   while (i>0)                                     
386     {                                             
387       i--;                                        
388       delete columns[i];                          
389     }                                             
390                                                   
391   return true;                                    
392 }                                                 
393                                                   
394                                                   
395 G4bool G4DNACrossSectionDataSet::SaveData(cons    
396 {                                                 
397   const std::size_t n(NumberOfComponents());      
398                                                   
399   if (n==0)                                       
400     {                                             
401       G4Exception("G4DNACrossSectionDataSet::S    
402                       FatalException,"Expected    
403                                                   
404       return false;                               
405     }                                             
406                                                   
407   G4String fullFileName(FullFileName(argFileNa    
408   std::ofstream out(fullFileName);                
409                                                   
410   if (!out.is_open())                             
411     {                                             
412       G4String message("Cannot open \"");         
413       message+=fullFileName;                      
414       message+="\"";                              
415       G4Exception("G4DNACrossSectionDataSet::S    
416                       FatalException,message);    
417       return false;                               
418     }                                             
419                                                   
420   auto iEnergies(GetComponent(0)->GetEnergies(    
421   auto iEnergiesEnd(GetComponent(0)->GetEnergi    
422   auto  iData(new G4DataVector::const_iterator    
423                                                   
424   std::size_t k(n);                               
425                                                   
426   while (k>0)                                     
427     {                                             
428       k--;                                        
429       iData[k]=GetComponent((G4int)k)->GetData    
430     }                                             
431                                                   
432   while (iEnergies!=iEnergiesEnd)                 
433     {                                             
434       out.precision(10);                          
435       out.width(15);                              
436       out.setf(std::ofstream::left);              
437       out << ((*iEnergies)/GetUnitEnergies());    
438                                                   
439       k=0;                                        
440                                                   
441       while (k<n)                                 
442   {                                               
443     out << ' ';                                   
444     out.precision(10);                            
445     out.width(15);                                
446     out.setf(std::ofstream::left);                
447     out << ((*(iData[k]))/GetUnitData());         
448                                                   
449     iData[k]++;                                   
450     k++;                                          
451   }                                               
452                                                   
453       out << std::endl;                           
454                                                   
455       iEnergies++;                                
456     }                                             
457                                                   
458   delete[] iData;                                 
459                                                   
460   return true;                                    
461 }                                                 
462                                                   
463                                                   
464 G4String G4DNACrossSectionDataSet::FullFileNam    
465 {                                                 
466   const char* path = G4FindDataDir("G4LEDATA")    
467   if (path == nullptr)                            
468   {                                               
469       G4Exception("G4DNACrossSectionDataSet::F    
470                       FatalException,"G4LEDATA    
471                                                   
472       return "";                                  
473   }                                               
474                                                   
475   std::ostringstream fullFileName;                
476                                                   
477   fullFileName << path << "/" << argFileName <    
478                                                   
479   return G4String(fullFileName.str().c_str());    
480 }                                                 
481                                                   
482                                                   
483 G4double G4DNACrossSectionDataSet::FindValue(G    
484 {                                                 
485   // Returns the sum over the shells correspon    
486   G4double value = 0.;                            
487                                                   
488   auto i(components.begin());                     
489   auto end(components.end());                     
490                                                   
491   while (i!=end)                                  
492     {                                             
493       value+=(*i)->FindValue(argEnergy);          
494       i++;                                        
495     }                                             
496                                                   
497   return value;                                   
498 }                                                 
499                                                   
500                                                   
501 void G4DNACrossSectionDataSet::PrintData() con    
502 {                                                 
503   const auto  n = (G4int)NumberOfComponents();    
504                                                   
505   G4cout << "The data set has " << n << " comp    
506   G4cout << G4endl;                               
507                                                   
508   G4int i(0);                                     
509                                                   
510   while (i<n)                                     
511     {                                             
512       G4cout << "--- Component " << i << " ---    
513       GetComponent(i)->PrintData();               
514       ++i;                                        
515     }                                             
516 }                                                 
517                                                   
518                                                   
519 void G4DNACrossSectionDataSet::SetEnergiesData    
520            G4DataVector* argData,                 
521            G4int argComponentId)                  
522 {                                                 
523   G4VEMDataSet * component(components[argCompo    
524                                                   
525   if (component != nullptr)                       
526     {                                             
527       component->SetEnergiesData(argEnergies,     
528       return;                                     
529     }                                             
530                                                   
531   std::ostringstream message;                     
532   message << "Component " << argComponentId <<    
533                                                   
534   G4Exception("G4DNACrossSectionDataSet::SetEn    
535                  FatalException,message.str().    
536                                                   
537 }                                                 
538                                                   
539                                                   
540 void G4DNACrossSectionDataSet::SetLogEnergiesD    
541            G4DataVector* argData,                 
542                                          G4Dat    
543                                          G4Dat    
544            G4int argComponentId)                  
545 {                                                 
546   G4VEMDataSet * component(components[argCompo    
547                                                   
548   if (component != nullptr)                       
549     {                                             
550       component->SetLogEnergiesData(argEnergie    
551       return;                                     
552     }                                             
553                                                   
554   std::ostringstream message;                     
555   message << "Component " << argComponentId <<    
556                                                   
557   G4Exception("G4DNACrossSectionDataSet::SetLo    
558                  FatalException,message.str().    
559                                                   
560 }                                                 
561                                                   
562                                                   
563 void G4DNACrossSectionDataSet::CleanUpComponen    
564 {                                                 
565   while (!components.empty())                     
566     {                                             
567       if (components.back() != nullptr) delete    
568       components.pop_back();                      
569     }                                             
570 }                                                 
571                                                   
572                                                   
573