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LibSedML	
  
h*p://libsedml.sf.net	
  	
  
      Frank	
  T.	
  Bergmann	
  
                     	
  
  HARMONY	
  2012,	
  Maastricht,	
  NL	
  
Repeatable	
  simulaHon	
  experiments	
  
               SimulaHon	
                              Model	
  




                                         Task	
  



 Reports	
  


                               Data	
  Generators	
  




                                                                    2	
  
LibSedML	
  
SED-­‐ML	
  Script	
  Editor	
  

                                             libSedMLScript	
  




                                                libSedML	
  




                                            libSedMLRunner	
  


     SimulaHon	
  Tool	
  
                                                                    iBioSim	
  
                                                                   RoadRunner	
  
                                   h*p://libsedml.sf.net	
  	
                      3	
  
LibSedML	
  script	
  
AddTimeCourseSimulation('simulation1',	
  'KiSAO:0000071',	
  0,	
  50,	
  
1000,	
  1000)	
  
	
  
AddModel('model1',	
  'urn:miriam:biomodels.db:BIOMD0000000021')	
  
	
  
AddModel('model2',	
  'model1')	
  
AddParameterChange('model2',	
  'V_mT',	
  '0.28')	
  
AddParameterChange('model2',	
  'V_dT',	
  '4.8')	
  
	
  
AddTask('task1',	
  'simulation1',	
  'model1')	
  
AddTask('task2',	
  'simulation1',	
  'model2')	
  
	
  
AddColumn('time',	
  [['time',	
  'task1',	
  'time']])	
  
AddColumn('Mt_original',	
  [['v1',	
  'task1',	
  'Mt']])	
  
AddColumn('Mt_chaotic',	
  [['v2',	
  'task2',	
  'Mt']])	
  
AddColumn('Mt_combined',	
  [['v1',	
  'task1',	
  'Mt'],	
  ['v2',	
  'task2',	
  
'Mt'],	
  'v1	
  -­‐	
  v2	
  +	
  20'])	
  
	
  
AddPlot('plot1',	
  'tim	
  mRNA	
  with	
  Oscillation	
  and	
  Chaos',	
  [['time',	
  
'Mt_original'],	
  ['time',	
  'Mt_chaotic'],	
  ['time',	
  
'Mt_combined']]);	
  




             h*p://libsedml.sf.net	
  	
                                                     4	
  
libSedML	
  




h*p://libsedml.sf.net	
  	
     5	
  
Features
                                       	
  
•  LibSedML	
  
   –  Read,	
  Create,	
  Write,	
  Manipulate	
  
   –  Validate,	
  Archive	
  
   –  Resolve	
  models	
  from	
  FS,	
  Web	
  +	
  Miriam	
  URN	
  
   –  Applies	
  changes	
  to	
  models	
  


•  Supported	
  Model	
  DescripHon	
  languages:	
  	
  
   –  SBML	
  +	
  CellML	
  

                                                                          6	
  
SED-­‐ML	
  script	
  editor	
  




      h*p://libsedml.sf.net	
  	
     7	
  
SED-­‐ML	
  script	
  editor	
  




      h*p://libsedml.sf.net	
  	
     8	
  
SBW	
  SimulaHon	
  Tool	
  




h*p://sourceforge.net/projects/sbw/files/sbw/2.9.0/	
  	
     9	
  
SED-­‐ML	
  Web	
  Tools	
  




h*p://sysbioapps.dyndns.org/SED-­‐ML_Web_Tools	
  	
  	
     10	
  
HARMONY	
  2012	
  
•  Tuesday	
  11am:	
  	
  
    –  TroubleshooHng	
  session:	
  ROOM	
  123	
  


•  Wednesday	
  11am:	
  	
  
    –  Nested	
  SimulaHons,	
  ROOM	
  147	
  




                                                       11	
  

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libSEDML (Harmony 2012)

  • 1. LibSedML   h*p://libsedml.sf.net     Frank  T.  Bergmann     HARMONY  2012,  Maastricht,  NL  
  • 2. Repeatable  simulaHon  experiments   SimulaHon   Model   Task   Reports   Data  Generators   2  
  • 3. LibSedML   SED-­‐ML  Script  Editor   libSedMLScript   libSedML   libSedMLRunner   SimulaHon  Tool   iBioSim   RoadRunner   h*p://libsedml.sf.net     3  
  • 4. LibSedML  script   AddTimeCourseSimulation('simulation1',  'KiSAO:0000071',  0,  50,   1000,  1000)     AddModel('model1',  'urn:miriam:biomodels.db:BIOMD0000000021')     AddModel('model2',  'model1')   AddParameterChange('model2',  'V_mT',  '0.28')   AddParameterChange('model2',  'V_dT',  '4.8')     AddTask('task1',  'simulation1',  'model1')   AddTask('task2',  'simulation1',  'model2')     AddColumn('time',  [['time',  'task1',  'time']])   AddColumn('Mt_original',  [['v1',  'task1',  'Mt']])   AddColumn('Mt_chaotic',  [['v2',  'task2',  'Mt']])   AddColumn('Mt_combined',  [['v1',  'task1',  'Mt'],  ['v2',  'task2',   'Mt'],  'v1  -­‐  v2  +  20'])     AddPlot('plot1',  'tim  mRNA  with  Oscillation  and  Chaos',  [['time',   'Mt_original'],  ['time',  'Mt_chaotic'],  ['time',   'Mt_combined']]);   h*p://libsedml.sf.net     4  
  • 6. Features   •  LibSedML   –  Read,  Create,  Write,  Manipulate   –  Validate,  Archive   –  Resolve  models  from  FS,  Web  +  Miriam  URN   –  Applies  changes  to  models   •  Supported  Model  DescripHon  languages:     –  SBML  +  CellML   6  
  • 7. SED-­‐ML  script  editor   h*p://libsedml.sf.net     7  
  • 8. SED-­‐ML  script  editor   h*p://libsedml.sf.net     8  
  • 9. SBW  SimulaHon  Tool   h*p://sourceforge.net/projects/sbw/files/sbw/2.9.0/     9  
  • 10. SED-­‐ML  Web  Tools   h*p://sysbioapps.dyndns.org/SED-­‐ML_Web_Tools       10  
  • 11. HARMONY  2012   •  Tuesday  11am:     –  TroubleshooHng  session:  ROOM  123   •  Wednesday  11am:     –  Nested  SimulaHons,  ROOM  147   11