libSBML C++ API
5.18.0
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The FbcSpeciesPlugin class codifies an extension of the core SBML Species class defined in the SBML Level 3 Flux Balance Constraints (“fbc”) package. The “fbc” package adds two attributes named "charge" and "chemicalFormula" to Species.
The optional attribute "charge" can contain a signed integer that refers to the Species object's electrical charge (in terms of electrons, not the SI unit of coulombs). Note that this attribute is therefore defined as it is in the SBML Level 2 Version 1 specification. (The charge attribute was removed in higher Versions and Levels of SBML, and is not an attribute of SBML Species in core SBML Level 3. However, it is useful for flux balance constraints models, and thus, the Level 3 “fbc” package adds it.)
The optional attribute "chemicalFormula" can contain a text string that represents the elemental composition of the substance represented by the Species object. The purpose of the "chemicalFormula" attribute is to allow balancing and validating reactions. This is particularly important in constraint-based models. The format of "chemicalFormula" must consist only of atomic names (as given in the Periodic Table of elements) or user-defined compounds, either of which take the form of a single capital letter followed by zero or more lowercase letters. Where there is more than a single atom present, this is indicated with an integer. With regards to order (and to enhance interoperability of models), users are advised to employ the Hill system order. Using this notation, the number of carbon atoms in a molecule is indicated first, followed by the number of hydrogen atoms, and then the number of all other chemical elements in alphabetical order. When the formula contains no carbon, all elements including hydrogen are listed alphabetically.
Here is an example of the XML form of an extended Species definition with these attributes:
<species metaid="meta_M_atp_c" id="M_atp_c" name="ATP" compartment="Cytosol" boundaryCondition="false" initialConcentration="0" hasOnlySubstanceUnits="false" fbc:charge="-4" fbc:chemicalFormula="C10H12N5O13P3"/>
Public Member Functions | |
virtual FbcSpeciesPlugin * | clone () const |
Creates and returns a deep copy of this FbcSpeciesPlugin object. More... | |
FbcSpeciesPlugin (const std::string &uri, const std::string &prefix, FbcPkgNamespaces *fbcns) | |
Creates a new FbcSpeciesPlugin. More... | |
FbcSpeciesPlugin (const FbcSpeciesPlugin &orig) | |
Copy constructor for FbcSpeciesPlugin. More... | |
virtual List * | getAllElements (ElementFilter *filter=NULL) |
Returns all child objects of this object. More... | |
virtual int | getCharge () const |
doxygenLibsbmlInternal More... | |
virtual const std::string & | getChemicalFormula () const |
Returns the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin. More... | |
virtual SBase * | getElementByMetaId (const std::string &metaid) |
Return the first child object found with a given meta identifier. More... | |
virtual SBase * | getElementBySId (const std::string &id) |
Return the first child object found with a given identifier. More... | |
const std::string & | getElementNamespace () const |
Returns the namespace URI of the package to which this plugin object belongs. More... | |
unsigned int | getLevel () const |
Returns the SBML Level of the package extension of this plugin object. More... | |
const std::string & | getPackageName () const |
Returns the short-form name of the package to which this plugin object belongs. More... | |
unsigned int | getPackageVersion () const |
Returns the package version of the package extension of this plugin object. More... | |
SBase * | getParentSBMLObject () |
Returns the parent object to which this plugin object is connected. More... | |
const SBase * | getParentSBMLObject () const |
Returns the parent object to which this plugin object is connected. More... | |
const std::string & | getPrefix () const |
Returns the XML namespace prefix of the package to which this plugin object belongs. More... | |
SBMLDocument * | getSBMLDocument () |
Returns the SBMLDocument object containing this object instance. More... | |
const SBMLDocument * | getSBMLDocument () const |
Returns the SBMLDocument object containing this object instance. More... | |
std::string | getURI () const |
Returns the XML namespace URI for the package to which this object belongs. More... | |
unsigned int | getVersion () const |
Returns the Version within the SBML Level of the package extension of this plugin object. More... | |
virtual bool | isSetCharge () const |
Predicate returning true or false depending on whether this FbcSpeciesPlugin's "charge" attribute has been set. More... | |
virtual bool | isSetChemicalFormula () const |
Predicate returning true or false depending on whether this FbcSpeciesPlugin's "chemicalFormula" attribute has been set. More... | |
virtual bool | isValidTypeForList (SBase *item) const |
FbcSpeciesPlugin & | operator= (const FbcSpeciesPlugin &rhs) |
Assignment operator for FbcSpeciesPlugin. More... | |
virtual void | renameMetaIdRefs (const std::string &oldid, const std::string &newid) |
Replaces all uses of a given meta identifier attribute value with another value. More... | |
virtual void | renameSIdRefs (const std::string &oldid, const std::string &newid) |
Replaces all uses of a given SIdRef type attribute value with another value. More... | |
virtual void | renameUnitSIdRefs (const std::string &oldid, const std::string &newid) |
Replaces all uses of a given UnitSIdRef type attribute value with another value. More... | |
virtual int | setCharge (int charge) |
Sets the value of the "charge" attribute of this FbcSpeciesPlugin. More... | |
virtual int | setChemicalFormula (const std::string &chemicalFormula) |
Sets the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin. More... | |
int | setElementNamespace (const std::string &uri) |
Sets the XML namespace to which this object belongs. More... | |
virtual int | unsetCharge () |
Unsets the value of the "charge" attribute of this FbcSpeciesPlugin. More... | |
virtual int | unsetChemicalFormula () |
Unsets the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin. More... | |
virtual | ~FbcSpeciesPlugin () |
Destructor for FbcSpeciesPlugin. More... | |
FbcSpeciesPlugin::FbcSpeciesPlugin | ( | const std::string & | uri, |
const std::string & | prefix, | ||
FbcPkgNamespaces * | fbcns | ||
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Creates a new FbcSpeciesPlugin.
FbcSpeciesPlugin::FbcSpeciesPlugin | ( | const FbcSpeciesPlugin & | orig | ) |
Copy constructor for FbcSpeciesPlugin.
orig; | the FbcSpeciesPlugin instance to copy. |
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virtual |
Destructor for FbcSpeciesPlugin.
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virtual |
Creates and returns a deep copy of this FbcSpeciesPlugin object.
Reimplemented from SBasePlugin.
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virtualinherited |
Returns all child objects of this object.
This returns a List object containing all child SBase objects of this one, at any nesting depth. Optionally, callers can supply a filter that will establish the search criteria for matching objects.
filter | a pointer to an ElementFilter, which causes the function to return only elements that match a particular set of constraints. If NULL (the default), the function will return all child objects. |
Reimplemented in GroupsModelPlugin, FbcModelPlugin, MultiCompartmentPlugin, LayoutModelPlugin, RenderListOfLayoutsPlugin, MultiSpeciesPlugin, FbcReactionPlugin, MultiSimpleSpeciesReferencePlugin, CompModelPlugin, CompSBasePlugin, CompSBMLDocumentPlugin, RenderLayoutPlugin, MultiSpeciesReferencePlugin, MultiModelPlugin, and QualModelPlugin.
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virtual |
doxygenLibsbmlInternal
doxygenLibsbmlInternal doxygenLibsbmlInternal doxygenLibsbmlInternal doxygenLibsbmlInternal Returns the value of the "charge" attribute of this FbcSpeciesPlugin.
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Returns the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin.
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virtualinherited |
Return the first child object found with a given meta identifier.
This method searches all the subobjects under this one, compares their meta identifiers to metaid
, and returns the first one that machines.
metaid | string, the metaid of the object to find. |
metaid
. Reimplemented in QualModelPlugin, GroupsModelPlugin, CompModelPlugin, CompSBasePlugin, and CompSBMLDocumentPlugin.
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virtualinherited |
Return the first child object found with a given identifier.
This method searches all the subobjects under this one, compares their identifiers to id
, and returns the first one that machines. It uses SBasePlugin::getAllElements(ElementFilter* filter) to get the list of identifiers, so the order in which identifiers are searched is the order in which they appear in the results returned by that method.
Normally, SId
type identifier values are unique across a model in SBML. However, in some circumstances they may not be, such as if a model is invalid because of multiple objects having the same identifier.
id | string representing the identifier of the object to find. |
id
. Reimplemented in QualModelPlugin, GroupsModelPlugin, CompModelPlugin, CompSBasePlugin, and CompSBMLDocumentPlugin.
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inherited |
Returns the namespace URI of the package to which this plugin object belongs.
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inherited |
Returns the SBML Level of the package extension of this plugin object.
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inherited |
Returns the short-form name of the package to which this plugin object belongs.
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inherited |
Returns the package version of the package extension of this plugin object.
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inherited |
Returns the parent object to which this plugin object is connected.
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inherited |
Returns the parent object to which this plugin object is connected.
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inherited |
Returns the XML namespace prefix of the package to which this plugin object belongs.
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inherited |
Returns the SBMLDocument object containing this object instance.
This method allows the caller to obtain the SBMLDocument for the current object.
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inherited |
Returns the SBMLDocument object containing this object instance.
This method allows the caller to obtain the SBMLDocument for the current object.
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inherited |
Returns the XML namespace URI for the package to which this object belongs.
"http://www.sbml.org/sbml/level3/version1/core"
. Individual SBML Level 3 packages define their own XML namespaces; for example, all elements belonging to the SBML Level 3 Layout Version 1 package must be placed in the XML namespace "http://www.sbml.org/sbml/level3/version1/layout/version1/"
.This method first looks into the SBMLNamespaces object possessed by the parent SBMLDocument object of the current object. If this cannot be found, this method returns the result of getElementNamespace().
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inherited |
Returns the Version within the SBML Level of the package extension of this plugin object.
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virtual |
Predicate returning true
or false
depending on whether this FbcSpeciesPlugin's "charge" attribute has been set.
true
if this FbcSpeciesPlugin's "charge" attribute has been set, otherwise false
is returned.
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virtual |
Predicate returning true
or false
depending on whether this FbcSpeciesPlugin's "chemicalFormula" attribute has been set.
true
if this FbcSpeciesPlugin's "chemicalFormula" attribute has been set, otherwise false
is returned.
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virtualinherited |
FbcSpeciesPlugin & FbcSpeciesPlugin::operator= | ( | const FbcSpeciesPlugin & | rhs | ) |
Assignment operator for FbcSpeciesPlugin.
rhs; | the object whose values are used as the basis of the assignment |
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virtualinherited |
Replaces all uses of a given meta identifier attribute value with another value.
ID
; the SBML object attribute itself is typically named metaid
. All attributes that hold values referring to values of type ID
are of the XML data type IDREF
. They are also sometimes informally referred to as "metaid refs", in analogy to the SBML-defined type SIdRef
.This method works by looking at all meta-identifier attribute values, comparing the identifiers to the value of oldid
. If any matches are found, the matching identifiers are replaced with newid
. The method does not descend into child elements.
oldid | the old identifier. |
newid | the new identifier. |
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virtualinherited |
Replaces all uses of a given SIdRef
type attribute value with another value.
In SBML, object identifiers are of a data type called SId
. In SBML Level 3, an explicit data type called SIdRef
was introduced for attribute values that refer to SId
values; in previous Levels of SBML, this data type did not exist and attributes were simply described to as "referring to an identifier", but the effective data type was the same as SIdRef
in Level 3. These and other methods of libSBML refer to the type SIdRef
for all Levels of SBML, even if the corresponding SBML specification did not explicitly name the data type.
This method works by looking at all attributes and (if appropriate) mathematical formulas in MathML content, comparing the referenced identifiers to the value of oldid
. If any matches are found, the matching values are replaced with newid
. The method does not descend into child elements.
oldid | the old identifier. |
newid | the new identifier. |
Reimplemented in FbcReactionPlugin.
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virtualinherited |
Replaces all uses of a given UnitSIdRef
type attribute value with another value.
UnitSId
. In SBML Level 3, an explicit data type called UnitSIdRef
was introduced for attribute values that refer to UnitSId
values; in previous Levels of SBML, this data type did not exist and attributes were simply described to as "referring to a unit identifier", but the effective data type was the same as UnitSIdRef
in Level 3. These and other methods of libSBML refer to the type UnitSIdRef
for all Levels of SBML, even if the corresponding SBML specification did not explicitly name the data type.This method works by looking at all unit identifier attribute values (including, if appropriate, inside mathematical formulas), comparing the referenced unit identifiers to the value of oldid
. If any matches are found, the matching values are replaced with newid
. The method does not descend into child elements.
oldid | the old identifier. |
newid | the new identifier. |
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Sets the value of the "charge" attribute of this FbcSpeciesPlugin.
charge; | int value of the "charge" attribute to be set |
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Sets the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin.
chemicalFormula; | const std::string& value of the "chemicalFormula" attribute to be set |
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inherited |
Sets the XML namespace to which this object belongs.
"http://www.sbml.org/sbml/level3/version1/core"
. Individual SBML Level 3 packages define their own XML namespaces; for example, all elements belonging to the SBML Level 3 Layout Version 1 package must be placed in the XML namespace "http://www.sbml.org/sbml/level3/version1/layout/version1/"
.uri | the URI to assign to this object. |
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Unsets the value of the "charge" attribute of this FbcSpeciesPlugin.
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Unsets the value of the "chemicalFormula" attribute of this FbcSpeciesPlugin.