END_TEST
START_TEST (test_Reaction_getProductById)
{
SpeciesReference_t *sr1 = SpeciesReference_create(2, 4);
SpeciesReference_setSpecies(sr1, "P1");
SpeciesReference_t *sr2 = SpeciesReference_create(2, 4);
SpeciesReference_setSpecies(sr2, "P1");
Reaction_addProduct(R, sr1);
Reaction_addProduct(R, sr2);
fail_unless( Reaction_getNumReactants(R) == 0 );
fail_unless( Reaction_getNumProducts (R) == 2 );
fail_unless( Reaction_getNumModifiers(R) == 0 );
fail_unless( Reaction_getProductBySpecies(R, "P1") != sr1 );
fail_unless( Reaction_getProductBySpecies(R, "P2") != sr2 );
fail_unless( Reaction_getProductBySpecies(R, "P3") == NULL );
SpeciesReference_free(sr1);
SpeciesReference_free(sr2);
}
END_TEST
START_TEST (test_Reaction_addModifier1)
{
Reaction_t *m = Reaction_create(2, 2);
SpeciesReference_t *p
= SpeciesReference_createModifier(2, 2);
SpeciesReference_t *p1
= SpeciesReference_createModifier(2, 2);
SpeciesReference_setSpecies(p1, "k");
SpeciesReference_setId(p1, "k1");
int i = Reaction_addModifier(m, p);
fail_unless( i == LIBSBML_INVALID_OBJECT);
SpeciesReference_setSpecies(p, "k");
SpeciesReference_setId(p, "k1");
i = Reaction_addModifier(m, p);
fail_unless( i == LIBSBML_OPERATION_SUCCESS);
fail_unless( Reaction_getNumModifiers(m) == 1);
i = Reaction_addModifier(m, p1);
fail_unless( i == LIBSBML_DUPLICATE_OBJECT_ID);
fail_unless( Reaction_getNumModifiers(m) == 1);
SpeciesReference_free(p);
SpeciesReference_free(p1);
Reaction_free(m);
}
END_TEST
START_TEST (test_Reaction_getProduct)
{
SpeciesReference_t *sr1 = SpeciesReference_create(2, 4);
SpeciesReference_t *sr2 = SpeciesReference_create(2, 4);
SpeciesReference_setSpecies(sr1, "P1");
SpeciesReference_setSpecies(sr2, "P2");
Reaction_addProduct(R, sr1);
Reaction_addProduct(R, sr2);
SpeciesReference_free(sr1);
SpeciesReference_free(sr2);
fail_unless( Reaction_getNumReactants(R) == 0 );
fail_unless( Reaction_getNumProducts (R) == 2 );
fail_unless( Reaction_getNumModifiers(R) == 0 );
sr1 = Reaction_getProduct(R, 0);
sr2 = Reaction_getProduct(R, 1);
fail_unless( !strcmp(SpeciesReference_getSpecies(sr1), "P1") );
fail_unless( !strcmp(SpeciesReference_getSpecies(sr2), "P2") );
}
END_TEST
START_TEST (test_Reaction_getModifierById)
{
SpeciesReference_t *msr1 = SpeciesReference_createModifier(2, 4);
SpeciesReference_t *msr2 = SpeciesReference_createModifier(2, 4);
SpeciesReference_setSpecies(msr1, "M1");
SpeciesReference_setSpecies(msr2, "M2");
Reaction_addModifier(R, msr1);
Reaction_addModifier(R, msr2);
fail_unless( Reaction_getNumReactants(R) == 0 );
fail_unless( Reaction_getNumProducts (R) == 0 );
fail_unless( Reaction_getNumModifiers(R) == 2 );
fail_unless( Reaction_getModifierBySpecies(R, "M1") != msr1 );
fail_unless( Reaction_getModifierBySpecies(R, "M2") != msr2 );
fail_unless( Reaction_getModifierBySpecies(R, "M3") == NULL );
SpeciesReference_free(msr1);
SpeciesReference_free(msr2);
}
END_TEST
START_TEST (test_SpeciesReference_setSpecies)
{
const char *species = "X0";
SpeciesReference_setSpecies(SR, species);
fail_unless( !strcmp(SpeciesReference_getSpecies(SR), species) );
fail_unless( SpeciesReference_isSetSpecies(SR) );
if (SpeciesReference_getSpecies(SR) == species)
{
fail("SpeciesReference_setSpecies(...) did not make a copy of string.");
}
/* Reflexive case (pathological) */
SpeciesReference_setSpecies(SR, SpeciesReference_getSpecies(SR));
fail_unless( !strcmp(SpeciesReference_getSpecies(SR), species) );
SpeciesReference_setSpecies(SR, NULL);
fail_unless( !SpeciesReference_isSetSpecies(SR) );
if (SpeciesReference_getSpecies(SR) != NULL)
{
fail("SpeciesReference_setSpecies(SR, NULL) did not clear string.");
}
}
END_TEST
START_TEST (test_Reaction_getModifier)
{
SpeciesReference_t *msr1 = SpeciesReference_createModifier(2, 4);
SpeciesReference_t *msr2 = SpeciesReference_createModifier(2, 4);
SpeciesReference_setSpecies(msr1, "M1");
SpeciesReference_setSpecies(msr2, "M2");
Reaction_addModifier(R, msr1);
Reaction_addModifier(R, msr2);
SpeciesReference_free(msr1);
SpeciesReference_free(msr2);
fail_unless( Reaction_getNumReactants(R) == 0 );
fail_unless( Reaction_getNumProducts (R) == 0 );
fail_unless( Reaction_getNumModifiers(R) == 2 );
msr1 = Reaction_getModifier(R, 0);
msr2 = Reaction_getModifier(R, 1);
fail_unless(!strcmp(SpeciesReference_getSpecies(msr1), "M1"));
fail_unless(!strcmp(SpeciesReference_getSpecies(msr2), "M2"));
}
END_TEST
START_TEST (test_SBMLConvert_addModifiersToReaction)
{
SBMLDocument_t *d = SBMLDocument_createWithLevelAndVersion(1, 2);
Model_t *m = SBMLDocument_createModel(d);
Reaction_t *r = Model_createReaction(m);
KineticLaw_t *kl = Reaction_createKineticLaw(r);
KineticLaw_setFormula(kl, "k1*S1*S2*S3*S4*S5");
SpeciesReference_t *ssr1;
SpeciesReference_t *ssr2;
Species_t *s1 = Model_createSpecies( m );
Species_setId( s1, "S1" );
Species_t *s2 = Model_createSpecies( m );
Species_setId( s2, "S2");
Species_t *s3 = Model_createSpecies( m );
Species_setId( s3, "S3");
Species_t *s4 = Model_createSpecies( m );
Species_setId( s4, "S4");
Species_t *s5 = Model_createSpecies( m );
Species_setId( s5, "S5");
SpeciesReference_t *sr1 = Reaction_createReactant( r );
SpeciesReference_t *sr2 = Reaction_createReactant( r );
SpeciesReference_t *sr3 = Reaction_createProduct ( r );
SpeciesReference_setSpecies(sr1, "S1");
SpeciesReference_setSpecies(sr2, "S2");
SpeciesReference_setSpecies(sr3, "S5");
fail_unless( Reaction_getNumModifiers(r) == 0, NULL );
fail_unless( SBMLDocument_setLevelAndVersionNonStrict(d, 2, 1) == 1, NULL );
fail_unless( SBMLDocument_getLevel (d) == 2, NULL );
fail_unless( SBMLDocument_getVersion(d) == 1, NULL );
fail_unless( Reaction_getNumModifiers(Model_getReaction(m, 0)) == 2, NULL );
ssr1 = (SpeciesReference_t *) Reaction_getModifier(Model_getReaction(m, 0), 0);
ssr2 = (SpeciesReference_t *) Reaction_getModifier(Model_getReaction(m, 0), 1);
fail_unless( !strcmp(SpeciesReference_getSpecies(ssr1), "S3"), NULL );
fail_unless( !strcmp(SpeciesReference_getSpecies(ssr2), "S4"), NULL );
SBMLDocument_free(d);
}
END_TEST
START_TEST (test_SpeciesReference_setSpecies4)
{
int i = SpeciesReference_setSpecies(sr, "mm");
fail_unless( i == LIBSBML_OPERATION_SUCCESS );
fail_unless( SpeciesReference_isSetSpecies(sr) );
i = SpeciesReference_setSpecies(sr, NULL);
fail_unless( i == LIBSBML_OPERATION_SUCCESS );
fail_unless( !SpeciesReference_isSetSpecies(sr) );
}
END_TEST
START_TEST (test_L3_SpeciesReference_species)
{
const char *species = "cell";
fail_unless( !SpeciesReference_isSetSpecies(SR) );
SpeciesReference_setSpecies(SR, species);
fail_unless( !strcmp(SpeciesReference_getSpecies(SR), species) );
fail_unless( SpeciesReference_isSetSpecies(SR) );
if (SpeciesReference_getSpecies(SR) == species)
{
fail("SpeciesReference_setSpecies(...) did not make a copy of string.");
}
SpeciesReference_unsetSpecies(SR);
fail_unless( !SpeciesReference_isSetSpecies(SR) );
}
END_TEST
START_TEST (test_ModifierSpeciesReference_setSpecies)
{
const char *s;
const char *species = "s1";
SpeciesReference_setSpecies(MSR, species);
s = SpeciesReference_getSpecies(MSR);
fail_unless( !strcmp(s, species) );
fail_unless(SpeciesReference_isSetSpecies(MSR));
if (SpeciesReference_getSpecies(MSR) == species)
{
fail( "ModifierSpeciesReference_setSpecies(...) "
"did not make a copy of string." );
}
/* Reflexive case (pathological) */
s = SpeciesReference_getSpecies(MSR);
SpeciesReference_setSpecies(MSR, s);
s = SpeciesReference_getSpecies(MSR);
fail_unless( !strcmp(s, species) );
SpeciesReference_setSpecies(MSR, NULL);
fail_unless(!SpeciesReference_isSetSpecies(MSR));
if (SpeciesReference_getSpecies(MSR) != NULL)
{
fail( "ModifierSpeciesReference_setSpecies(MSR, NULL) "
"did not clear string." );
}
}
END_TEST
START_TEST (test_SpeciesReference_setSpecies2)
{
SpeciesReference_t *c =
SpeciesReference_create(2, 2);
int i = SpeciesReference_setSpecies(c, "1cell");
fail_unless( i == LIBSBML_INVALID_ATTRIBUTE_VALUE );
fail_unless( !SpeciesReference_isSetSpecies(c) );
SpeciesReference_free(c);
}
END_TEST
START_TEST (test_Reaction_addModifier)
{
SpeciesReference_t * msr = SpeciesReference_createModifier(2, 4);
SpeciesReference_setSpecies(msr, "s");
Reaction_addModifier(R, msr);
fail_unless( Reaction_getNumReactants(R) == 0 );
fail_unless( Reaction_getNumProducts (R) == 0 );
fail_unless( Reaction_getNumModifiers(R) == 1 );
SpeciesReference_free(msr);
}
END_TEST
START_TEST (test_SpeciesReference_setSpecies3)
{
SpeciesReference_t *c =
SpeciesReference_create(2, 2);
int i = SpeciesReference_setSpecies(c, "mole");
fail_unless( i == LIBSBML_OPERATION_SUCCESS );
fail_unless( !strcmp(SpeciesReference_getSpecies(c), "mole") );
fail_unless( SpeciesReference_isSetSpecies(c) );
SpeciesReference_free(c);
}
END_TEST
START_TEST (test_Reaction_addModifier2)
{
Reaction_t *m = Reaction_create(2, 2);
SpeciesReference_t *p
= SpeciesReference_createModifier(2, 1);
SpeciesReference_setSpecies(p, "k");
int i = Reaction_addModifier(m, p);
fail_unless( i == LIBSBML_VERSION_MISMATCH);
fail_unless( Reaction_getNumModifiers(m) == 0);
SpeciesReference_free(p);
Reaction_free(m);
}
END_TEST
START_TEST (test_Reaction_addProduct3)
{
Reaction_t *m = Reaction_create(2, 2);
SpeciesReference_t *p
= SpeciesReference_create(1, 2);
SpeciesReference_setSpecies(p, "k");
int i = Reaction_addProduct(m, p);
fail_unless( i == LIBSBML_LEVEL_MISMATCH);
fail_unless( Reaction_getNumProducts(m) == 0);
SpeciesReference_free(p);
Reaction_free(m);
}
END_TEST
START_TEST (test_L3_SpeciesReference_hasRequiredAttributes )
{
SpeciesReference_t *sr = SpeciesReference_create (3, 1);
fail_unless ( !SpeciesReference_hasRequiredAttributes(sr));
SpeciesReference_setSpecies(sr, "id");
fail_unless ( !SpeciesReference_hasRequiredAttributes(sr));
SpeciesReference_setConstant(sr, 0);
fail_unless ( SpeciesReference_hasRequiredAttributes(sr));
SpeciesReference_free(sr);
}
END_TEST
START_TEST (test_SBMLConvert_convertToL3_stoichiometryMath)
{
SBMLDocument_t *d = SBMLDocument_createWithLevelAndVersion(2, 1);
Model_t *m = SBMLDocument_createModel(d);
Compartment_t *c = Model_createCompartment(m);
Compartment_setId ( c, "c" );
Species_t *s = Model_createSpecies(m);
Species_setId(s, "s");
Species_setCompartment(s, "c");
Reaction_t * r = Model_createReaction(m);
SpeciesReference_t *sr = Reaction_createReactant(r);
SpeciesReference_setSpecies(sr, "s");
StoichiometryMath_t *sm = SpeciesReference_createStoichiometryMath(sr);
ASTNode_t * ast = SBML_parseFormula("c*2");
StoichiometryMath_setMath(sm, ast);
fail_unless(Model_getNumRules(m) == 0);
fail_unless(SpeciesReference_isSetId(sr) == 0);
fail_unless( SBMLDocument_setLevelAndVersionNonStrict(d, 3, 1) == 1);
m = SBMLDocument_getModel(d);
r = Model_getReaction(m, 0);
sr = Reaction_getReactant(r, 0);
fail_unless(Model_getNumRules(m) == 1);
fail_unless(SpeciesReference_isSetId(sr) == 1);
Rule_t *rule = Model_getRule(m, 0);
fail_unless( strcmp(SpeciesReference_getId(sr), Rule_getVariable(rule)) == 0 );
SBMLDocument_free(d);
}
END_TEST
START_TEST (test_SBMLConvert_convertToL3_localParameters)
{
SBMLDocument_t *d = SBMLDocument_createWithLevelAndVersion(1, 2);
Model_t *m = SBMLDocument_createModel(d);
Compartment_t *c = Model_createCompartment(m);
Compartment_setId ( c, "c" );
Species_t *s = Model_createSpecies(m);
Species_setId(s, "s");
Species_setCompartment(s, "c");
Reaction_t * r = Model_createReaction(m);
SpeciesReference_t *sr = Reaction_createReactant(r);
SpeciesReference_setSpecies(sr, "s");
KineticLaw_t *kl = Reaction_createKineticLaw(r);
KineticLaw_setFormula(kl, "s*k");
Parameter_t *p = KineticLaw_createParameter(kl);
Parameter_setId(p, "k");
fail_unless(KineticLaw_getNumLocalParameters(kl) == 0);
fail_unless( SBMLDocument_setLevelAndVersionNonStrict(d, 3, 1) == 1 );
m = SBMLDocument_getModel(d);
r = Model_getReaction(m,0);
kl = Reaction_getKineticLaw(r);
fail_unless(KineticLaw_getNumLocalParameters(kl) == 1);
LocalParameter_t *lp = KineticLaw_getLocalParameter(kl, 0);
SBMLDocument_free(d);
}
END_TEST
START_TEST (test_SBMLConvert_convertToL3_product)
{
SBMLDocument_t *d = SBMLDocument_createWithLevelAndVersion(2, 2);
Model_t *m = SBMLDocument_createModel(d);
Reaction_t *r = Model_createReaction(m);
SpeciesReference_t *sr = Reaction_createProduct(r);
SpeciesReference_t *sr1;
SpeciesReference_setSpecies ( sr, "s" );
fail_unless( SBMLDocument_setLevelAndVersionNonStrict(d, 3, 1) == 1, NULL);
sr1 = Reaction_getProduct(Model_getReaction(m, 0), 0);
fail_unless(SpeciesReference_hasRequiredAttributes(sr1) == 1);
SBMLDocument_free(d);
}
END_TEST
START_TEST (test_Reaction_removeModifier)
{
SpeciesReference_t *o1, *o2, *o3;
o1 = Reaction_createModifier(R);
o2 = Reaction_createModifier(R);
o3 = Reaction_createModifier(R);
SpeciesReference_setSpecies(o3, "test");
fail_unless( Reaction_removeModifier(R, 0) == o1 );
fail_unless( Reaction_getNumModifiers(R) == 2 );
fail_unless( Reaction_removeModifier(R, 0) == o2 );
fail_unless( Reaction_getNumModifiers(R) == 1 );
fail_unless( Reaction_removeModifierBySpecies(R,"test") == o3 );
fail_unless( Reaction_getNumModifiers(R) == 0 );
SpeciesReference_free(o1);
SpeciesReference_free(o2);
SpeciesReference_free(o3);
}
LIBSBML_CPP_NAMESPACE_USE
int main(int argc,char** argv)
{
int retval = 0;
XMLNamespaces_t * comp;
SBMLNamespaces_t * sbmlns;
SBMLDocument_t * doc;
Compartment_t * c;
Species_t * s1;
Species_t * s2;
Species_t * s3;
Species_t * s4;
Reaction_t * r1;
Reaction_t * r2;
SpeciesReference_t *sr1;
SpeciesReference_t *sr2;
SpeciesReference_t *sr3;
SpeciesReference_t *sr4;
SpeciesReference_t *sr5;
SpeciesReference_t *sr6;
Model_t * model;
CompSBMLDocumentPlugin_t * docPlug;
CompModelPlugin_t *modelPlug;
Submodel_t * sub1;
Submodel_t * sub2;
ModelDefinition_t * modDef;
/* get comp registry entry */
SBMLExtension_t *sbmlext = SBMLExtensionRegistry_getExtension("comp");
/* create the sbml namespaces object with comp */
comp = XMLNamespaces_create();
XMLNamespaces_add(comp, SBMLExtension_getURI(sbmlext, 3, 1, 1), "comp");
sbmlns = SBMLNamespaces_create(3, 1);
SBMLNamespaces_addNamespaces(sbmlns, comp);
/* create the document */
doc = SBMLDocument_createWithSBMLNamespaces(sbmlns);
/* set the comp reqd attribute to true */
docPlug = (CompSBMLDocumentPlugin_t * )(SBase_getPlugin((SBase_t*)(doc), "comp"));
SBMLDocumentPlugin_setRequired((SBMLDocumentPlugin_t*)(docPlug), 1);
/* create the submodel */
modDef = CompSBMLDocumentPlugin_createModelDefinition(docPlug);
Model_setId((Model_t*)(modDef), "enzyme");
Model_setName((Model_t*)(modDef), "enzyme");
c = Model_createCompartment((Model_t*)(modDef));
Compartment_setId(c, "comp");
Compartment_setConstant(c, 1);
Compartment_setSize(c, 1.0);
Compartment_setSpatialDimensions(c, 3);
s1 = Model_createSpecies((Model_t*)(modDef));
Species_setId(s1, "S");
Species_setCompartment(s1, "comp");
Species_setHasOnlySubstanceUnits(s1, 0);
Species_setBoundaryCondition(s1, 0);
Species_setConstant(s1, 0);
s2 = Model_createSpecies((Model_t*)(modDef));
Species_setId(s2, "E");
Species_setCompartment(s2, "comp");
Species_setHasOnlySubstanceUnits(s2, 0);
Species_setBoundaryCondition(s2, 0);
Species_setConstant(s2, 0);
s3 = Model_createSpecies((Model_t*)(modDef));
Species_setId(s3, "D");
Species_setCompartment(s3, "comp");
Species_setHasOnlySubstanceUnits(s3, 0);
Species_setBoundaryCondition(s3, 0);
Species_setConstant(s3, 0);
s4 = Model_createSpecies((Model_t*)(modDef));
Species_setId(s4, "ES");
Species_setCompartment(s4, "comp");
Species_setHasOnlySubstanceUnits(s4, 0);
Species_setBoundaryCondition(s4, 0);
Species_setConstant(s4, 0);
r1 = Model_createReaction((Model_t*)(modDef));
Reaction_setId(r1, "J0");
Reaction_setReversible(r1, 1);
Reaction_setFast(r1, 0);
sr1 = Reaction_createReactant(r1);
SpeciesReference_setSpecies(sr1, "S");
SpeciesReference_setStoichiometry(sr1, 1.0);
SpeciesReference_setConstant(sr1, 1);
sr2 = Reaction_createReactant(r1);
SpeciesReference_setSpecies(sr2, "E");
SpeciesReference_setStoichiometry(sr2, 1.0);
SpeciesReference_setConstant(sr2, 1);
sr3 = Reaction_createProduct(r1);
SpeciesReference_setSpecies(sr3, "ES");
SpeciesReference_setStoichiometry(sr3, 1.0);
SpeciesReference_setConstant(sr3, 1);
r2 = Model_createReaction((Model_t*)(modDef));
Reaction_setId(r2, "J1");
Reaction_setReversible(r2, 1);
Reaction_setFast(r2, 0);
sr4 = Reaction_createProduct(r2);
SpeciesReference_setSpecies(sr4, "E");
SpeciesReference_setStoichiometry(sr4, 1.0);
SpeciesReference_setConstant(sr4, 1);
sr5 = Reaction_createReactant(r2);
SpeciesReference_setSpecies(sr5, "ES");
SpeciesReference_setStoichiometry(sr5, 1.0);
SpeciesReference_setConstant(sr5, 1);
sr6 = Reaction_createProduct(r2);
SpeciesReference_setSpecies(sr6, "D");
SpeciesReference_setStoichiometry(sr6, 1.0);
SpeciesReference_setConstant(sr6, 1);
/* create the model */
model = SBMLDocument_createModel(doc);
Model_setId(model, "aggregate");
/* add the submodels*/
modelPlug = (CompModelPlugin_t*)(SBase_getPlugin((SBase_t *)(model), "comp"));
sub1 = CompModelPlugin_createSubmodel(modelPlug);
Submodel_setId(sub1, "submod1");
Submodel_setModelRef(sub1, "enzyme");
sub2 = CompModelPlugin_createSubmodel(modelPlug);
Submodel_setId(sub2, "submod2");
Submodel_setModelRef(sub2, "enzyme");
/* write the file */
writeSBMLToFile(doc, "enzyme_model.xml");
return retval;
}
END_TEST
START_TEST (test_create_l1v1_units)
{
Model_t *m;
Compartment_t *c;
KineticLaw_t *kl;
Parameter_t *p;
Reaction_t *r;
Species_t *s;
SpeciesReference_t *sr;
Unit_t *u;
UnitDefinition_t *ud;
/**
* <sbml level="1" version="1">
*/
m = Model_create(2, 4);
/**
* <unitDefinition name="substance">
* <listOfUnits>
* <unit kind="mole" scale="-3"/>
* </listOfUnits>
* </unitDefinition>
*/
ud = Model_createUnitDefinition(m);
UnitDefinition_setName(ud, "substance");
u = Model_createUnit(m);
Unit_setKind(u,UNIT_KIND_MOLE);
Unit_setScale(u, -3);
/**
* <unitDefinition name="mls">
* <listOfUnits>
* <unit kind="mole" scale="-3"/>
* <unit kind="liter" exponent="-1"/>
* <unit kind="second" exponent="-1"/>
* </listOfUnits>
* </unitDefinition>
*/
ud = Model_createUnitDefinition(m);
UnitDefinition_setName(ud, "mls");
u = Model_createUnit(m);
Unit_setKind(u, UNIT_KIND_MOLE);
Unit_setScale(u, -3);
u = Model_createUnit(m);
Unit_setKind(u, UNIT_KIND_LITER);
Unit_setExponent(u, -1);
u = Model_createUnit(m);
Unit_setKind(u, UNIT_KIND_SECOND);
Unit_setExponent(u, -1);
/**
* <listOfCompartments>
* <compartment name="cell"/>
* </listOfCompartments>
*/
c = Model_createCompartment(m);
Compartment_setName(c, "cell");
/**
* <listOfSpecies>
* <specie name="x0" compartment="cell" initialAmount="1"/>
* <specie name="x1" compartment="cell" initialAmount="1"/>
* <specie name="s1" compartment="cell" initialAmount="1"/>
* <specie name="s2" compartment="cell" initialAmount="1"/>
* </listOfSpecies>
*/
s = Model_createSpecies(m);
Species_setName(s, "x0");
Species_setCompartment(s, "cell");
Species_setInitialAmount(s, 1);
s = Model_createSpecies(m);
Species_setName(s, "x1");
Species_setCompartment(s, "cell");
Species_setInitialAmount(s, 1);
s = Model_createSpecies(m);
Species_setName(s, "s1");
Species_setCompartment(s, "cell");
Species_setInitialAmount(s, 1);
s = Model_createSpecies(m);
Species_setName(s, "s2");
Species_setCompartment(s, "cell");
Species_setInitialAmount(s, 1);
/**
* <listOfParameters>
* <parameter name="vm" value="2" units="mls"/>
* <parameter name="km" value="2"/>
* </listOfParameters>
*/
p = Model_createParameter(m);
Parameter_setName (p, "vm");
Parameter_setUnits(p, "mls");
Parameter_setValue(p, 2);
p = Model_createParameter(m);
Parameter_setName (p, "km");
Parameter_setValue(p, 2);
/**
* <reaction name="v1">
* <listOfReactants>
* <specieReference specie="x0"/>
* </listOfReactants>
* <listOfProducts>
* <specieReference specie="s1"/>
* </listOfProducts>
* <kineticLaw formula="(vm * s1)/(km + s1)"/>
* </reaction>
*/
r = Model_createReaction(m);
Reaction_setName(r, "v1");
sr = Model_createReactant(m);
SpeciesReference_setSpecies(sr, "x0");
sr = Model_createProduct(m);
SpeciesReference_setSpecies(sr, "s1");
kl = Model_createKineticLaw(m);
KineticLaw_setFormula(kl, "(vm * s1)/(km + s1)");
/**
* <reaction name="v2">
* <listOfReactants>
* <specieReference specie="s1"/>
* </listOfReactants>
* <listOfProducts>
* <specieReference specie="s2"/>
* </listOfProducts>
* <kineticLaw formula="(vm * s2)/(km + s2)"/>
* </reaction>
*/
r = Model_createReaction(m);
Reaction_setName(r, "v2");
sr = Model_createReactant(m);
SpeciesReference_setSpecies(sr, "s1");
sr = Model_createProduct(m);
SpeciesReference_setSpecies(sr, "s2");
kl = Model_createKineticLaw(m);
KineticLaw_setFormula(kl, "(vm * s2)/(km + s2)");
/**
* <reaction name="v3">
* <listOfReactants>
* <specieReference specie="s2"/>
* </listOfReactants>
* <listOfProducts>
* <specieReference specie="x1"/>
* </listOfProducts>
* <kineticLaw formula="(vm * s1)/(km + s1)"/>
* </reaction>
*/
r = Model_createReaction(m);
Reaction_setName(r, "v3");
sr = Model_createReactant(m);
SpeciesReference_setSpecies(sr, "s2");
sr = Model_createProduct(m);
SpeciesReference_setSpecies(sr, "x1");
kl = Model_createKineticLaw(m);
KineticLaw_setFormula(kl, "(vm * s1)/(km + s1)");
Model_free(m);
}
LIBSBML_CPP_NAMESPACE_USE
int main(int argc,char** argv)
{
int retval = 0;
XMLNamespaces_t * fbc;
SBMLNamespaces_t * sbmlns;
SBMLDocument_t * doc;
Compartment_t * compartment;
Species_t * species;
Reaction_t * reaction;
SpeciesReference_t *reactant;
SpeciesReference_t *product;
Model_t * model;
SBMLDocumentPlugin_t * docPlug;
SBasePlugin_t * modelPlug;
FluxBound_t * fluxBound;
Objective_t * objective;
FluxObjective_t * fluxObjective;
/* get fbc registry entry */
SBMLExtension_t *sbmlext = SBMLExtensionRegistry_getExtension("fbc");
/* create the sbml namespaces object with fbc */
fbc = XMLNamespaces_create();
XMLNamespaces_add(fbc, SBMLExtension_getURI(sbmlext, 3, 1, 1), "fbc");
sbmlns = SBMLNamespaces_create(3, 1);
SBMLNamespaces_addNamespaces(sbmlns, fbc);
/* create the document */
doc = SBMLDocument_createWithSBMLNamespaces(sbmlns);
/* set the fbc reqd attribute to false */
docPlug = (SBMLDocumentPlugin_t*)(SBase_getPlugin((SBase_t*)(doc), "fbc"));
SBMLDocumentPlugin_setRequired(docPlug, 0);
// create the Model
model = SBMLDocument_createModel(doc);
// create the Compartment
compartment = Model_createCompartment(model);
Compartment_setId(compartment, "compartment");
Compartment_setConstant(compartment, 1);
Compartment_setSize(compartment, 1);
// create the Species
species = Model_createSpecies(model);
Species_setId(species, "Node1");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node2");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node3");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node4");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node5");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node6");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node7");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node8");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 0);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node0");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 1);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
species = Model_createSpecies(model);
Species_setId(species, "Node9");
Species_setCompartment(species, "compartment");
Species_setBoundaryCondition(species, 1);
Species_setConstant(species, 0);
Species_setHasOnlySubstanceUnits(species, 0);
// create the Reactions
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J0");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node0");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node1");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J1");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node1");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node2");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J2");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node2");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node3");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J3");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node1");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node4");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J4");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node4");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node3");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J5");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node3");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node5");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J6");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node5");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node6");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J7");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node6");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node7");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J8");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node5");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node8");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J9");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node8");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node7");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
reaction = Model_createReaction(model);
Reaction_setId(reaction, "J10");
Reaction_setReversible(reaction, 0);
Reaction_setFast(reaction, 0);
reactant = Reaction_createReactant(reaction);
SpeciesReference_setSpecies(reactant, "Node7");
SpeciesReference_setStoichiometry(reactant, 1);
SpeciesReference_setConstant(reactant, 1);
product = Reaction_createProduct(reaction);
SpeciesReference_setSpecies(product, "Node9");
SpeciesReference_setStoichiometry(product, 1);
SpeciesReference_setConstant(product, 1);
// Get a SBasePlugin_t object plugged in the model object.
modelPlug = SBase_getPlugin((SBase_t *)(model), "fbc");
// create the fluxBound object and add it to model plugin
fluxBound = FluxBound_create(3, 1, 1);
FluxBound_setId(fluxBound, "bound1");
FluxBound_setReaction(fluxBound, "J0");
FluxBound_setOperation(fluxBound, "equal");
FluxBound_setValue(fluxBound, 10);
FbcModelPlugin_addFluxBound(modelPlug, fluxBound);
// create the objective object and add it to model plugin
objective = Objective_create(3, 1, 1);
Objective_setId(objective, "obj1");
Objective_setType(objective, "maximize");
fluxObjective = Objective_createFluxObjective(objective);
FluxObjective_setReaction(fluxObjective, "J8");
FluxObjective_setCoefficient(fluxObjective, 1);
FbcModelPlugin_addObjective(modelPlug, objective);
// mark obj1 as active objective
FbcModelPlugin_setActiveObjectiveId(modelPlug, "obj1");
/* write the file */
writeSBMLToFile(doc, "fbc_example1.xml");
return retval;
}
