Changeset 98c428 for src/Parser

Timestamp:

Feb 22, 2012, 11:27:55 AM (13 years ago)

Author:

Frederik Heber <heber@…>

Branches:

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

Children:

44f53e

Parents:

3dfd9c

git-author:

Frederik Heber <heber@…> (01/12/12 14:23:39)

git-committer:

Frederik Heber <heber@…> (02/22/12 11:27:55)

Message:

FormatParserStorage has now two convenience functions ::load().

• this way one doesn't have to find out the suffix anymore.

Location:

src/Parser

Files:

• FormatParserStorage.cpp (modified) (2 diffs)
• FormatParserStorage.hpp (modified) (2 diffs)

src/Parser/FormatParserStorage.cpp

@@ -237 +237 @@
 }
 
+/** Recognizes type of file and parse via FormatParserStorage::load().
+ * \param filename path and filename
+ * \return true - parsing ok, false - suffix unknown
+ */
+bool FormatParserStorage::load(boost::filesystem::path filename)
+{
+  return load(filename.string());
+}
+
+/** Recognizes type of file and parse via FormatParserStorage::load().
+ * \param filename path and filename
+ * \return true - parsing ok, false - suffix unknown
+ */
+bool FormatParserStorage::load(std::string &filename)
+{
+  std::string FilenameSuffix = filename.substr(filename.find_last_of('.')+1, filename.length());
+  ifstream input;
+  LOG(0, "STATUS: Loading filler molecule " << filename
+      << " of suffix " << FilenameSuffix << ".");
+  input.open(filename.c_str());
+  const bool status = load(input, FilenameSuffix);
+  input.close();
+
+  return status;
+}
 
 /** Parses an istream depending on its suffix
@@ -243 +268 @@
  * \return true - parsing ok, false - suffix unknown
  */
-bool FormatParserStorage::load(std::istream &input, std::string suffix)
+bool FormatParserStorage::load(std::istream &input, std::string &suffix)
 {
   enum ParserTypes type = getTypeFromSuffix(suffix);

src/Parser/FormatParserStorage.hpp

@@ -16 +16 @@
 #include "CodePatterns/Singleton.hpp"
 
+#include <boost/filesystem/path.hpp>
 #include <iosfwd>
 #include <map>
@@ -36 +37 @@
   bool add(ParserTypes type);
 
-  bool load(std::istream &input, std::string suffix);
+  bool load(boost::filesystem::path filename);
+  bool load(std::string &filename);
+  bool load(std::istream &input, std::string &suffix);
   bool save(std::ostream &output, std::string suffix, const std::vector<atom *> &atoms);
   bool saveSelectedAtoms(std::ostream &output, std::string suffix);