public class ModelledSubgroup extends Object
Java class for anonymous complex type.
The following schema fragment specifies the expected content contained within this class.
<complexType> <complexContent> <restriction base="{http://www.w3.org/2001/XMLSchema}anyType"> <sequence> <element ref="{}angle-outlier" maxOccurs="unbounded" minOccurs="0"/> <element ref="{}clash" maxOccurs="unbounded" minOccurs="0"/> <element ref="{}bond-outlier" maxOccurs="unbounded" minOccurs="0"/> <element ref="{}mog-angle-outlier" maxOccurs="unbounded" minOccurs="0"/> <choice> <element ref="{}symm-clash" maxOccurs="unbounded" minOccurs="0"/> <element ref="{}mog-bond-outlier" maxOccurs="unbounded" minOccurs="0"/> </choice> </sequence> <attribute name="NatomsEDS" use="required" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="altcode" use="required" type="{http://www.w3.org/2001/XMLSchema}anySimpleType" /> <attribute name="avgoccu" use="required" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="chain" use="required" type="{http://www.w3.org/2001/XMLSchema}NCName" /> <attribute name="ent" use="required" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="flippable-sidechain" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="icode" use="required" type="{http://www.w3.org/2001/XMLSchema}anySimpleType" /> <attribute name="ligRSRZ" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="ligRSRnbrMean" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="ligRSRnbrStdev" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="ligRSRnumnbrs" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="model" use="required" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="mogul-ignore" type="{http://www.w3.org/2001/XMLSchema}NCName" /> <attribute name="num-H-reduce" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="owab" use="required" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="phi" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="psi" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="rama" type="{http://www.w3.org/2001/XMLSchema}NCName" /> <attribute name="resname" use="required" type="{http://www.w3.org/2001/XMLSchema}NCName" /> <attribute name="resnum" use="required" type="{http://www.w3.org/2001/XMLSchema}integer" /> <attribute name="rota" type="{http://www.w3.org/2001/XMLSchema}anySimpleType" /> <attribute name="rscc" use="required" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="rsr" use="required" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="rsrz" type="{http://www.w3.org/2001/XMLSchema}decimal" /> <attribute name="said" use="required" type="{http://www.w3.org/2001/XMLSchema}NCName" /> <attribute name="seq" use="required" type="{http://www.w3.org/2001/XMLSchema}NMTOKEN" /> </restriction> </complexContent> </complexType>
Modifier and Type | Field and Description |
---|---|
protected String |
altcode |
protected List<AngleOutlier> |
angleOutlier |
protected BigDecimal |
avgoccu |
protected List<BondOutlier> |
bondOutlier |
protected String |
chain |
protected List<Clash> |
clash |
protected BigInteger |
ent |
protected BigInteger |
flippableSidechain |
protected String |
icode |
protected BigDecimal |
ligRSRnbrMean |
protected BigDecimal |
ligRSRnbrStdev |
protected BigInteger |
ligRSRnumnbrs |
protected BigDecimal |
ligRSRZ |
protected BigInteger |
model |
protected List<MogAngleOutlier> |
mogAngleOutlier |
protected List<MogBondOutlier> |
mogBondOutlier |
protected String |
mogulIgnore |
protected BigInteger |
natomsEDS |
protected BigInteger |
numHReduce |
protected BigDecimal |
owab |
protected BigDecimal |
phi |
protected BigDecimal |
psi |
protected String |
rama |
protected String |
resname |
protected BigInteger |
resnum |
protected String |
rota |
protected BigDecimal |
rscc |
protected BigDecimal |
rsr |
protected BigDecimal |
rsrz |
protected String |
said |
protected String |
seq |
protected List<SymmClash> |
symmClash |
Constructor and Description |
---|
ModelledSubgroup() |
Modifier and Type | Method and Description |
---|---|
String |
getAltcode()
Gets the value of the altcode property.
|
List<AngleOutlier> |
getAngleOutlier()
Gets the value of the angleOutlier property.
|
BigDecimal |
getAvgoccu()
Gets the value of the avgoccu property.
|
List<BondOutlier> |
getBondOutlier()
Gets the value of the bondOutlier property.
|
String |
getChain()
Gets the value of the chain property.
|
List<Clash> |
getClash()
Gets the value of the clash property.
|
BigInteger |
getEnt()
Gets the value of the ent property.
|
BigInteger |
getFlippableSidechain()
Gets the value of the flippableSidechain property.
|
String |
getIcode()
Gets the value of the icode property.
|
BigDecimal |
getLigRSRnbrMean()
Gets the value of the ligRSRnbrMean property.
|
BigDecimal |
getLigRSRnbrStdev()
Gets the value of the ligRSRnbrStdev property.
|
BigInteger |
getLigRSRnumnbrs()
Gets the value of the ligRSRnumnbrs property.
|
BigDecimal |
getLigRSRZ()
Gets the value of the ligRSRZ property.
|
BigInteger |
getModel()
Gets the value of the model property.
|
List<MogAngleOutlier> |
getMogAngleOutlier()
Gets the value of the mogAngleOutlier property.
|
List<MogBondOutlier> |
getMogBondOutlier()
Gets the value of the mogBondOutlier property.
|
String |
getMogulIgnore()
Gets the value of the mogulIgnore property.
|
BigInteger |
getNatomsEDS()
Gets the value of the natomsEDS property.
|
BigInteger |
getNumHReduce()
Gets the value of the numHReduce property.
|
BigDecimal |
getOwab()
Gets the value of the owab property.
|
BigDecimal |
getPhi()
Gets the value of the phi property.
|
BigDecimal |
getPsi()
Gets the value of the psi property.
|
String |
getRama()
Gets the value of the rama property.
|
String |
getResname()
Gets the value of the resname property.
|
BigInteger |
getResnum()
Gets the value of the resnum property.
|
String |
getRota()
Gets the value of the rota property.
|
BigDecimal |
getRscc()
Gets the value of the rscc property.
|
BigDecimal |
getRsr()
Gets the value of the rsr property.
|
BigDecimal |
getRsrz()
Gets the value of the rsrz property.
|
String |
getSaid()
Gets the value of the said property.
|
String |
getSeq()
Gets the value of the seq property.
|
List<SymmClash> |
getSymmClash()
Gets the value of the symmClash property.
|
void |
setAltcode(String value)
Sets the value of the altcode property.
|
void |
setAvgoccu(BigDecimal value)
Sets the value of the avgoccu property.
|
void |
setChain(String value)
Sets the value of the chain property.
|
void |
setEnt(BigInteger value)
Sets the value of the ent property.
|
void |
setFlippableSidechain(BigInteger value)
Sets the value of the flippableSidechain property.
|
void |
setIcode(String value)
Sets the value of the icode property.
|
void |
setLigRSRnbrMean(BigDecimal value)
Sets the value of the ligRSRnbrMean property.
|
void |
setLigRSRnbrStdev(BigDecimal value)
Sets the value of the ligRSRnbrStdev property.
|
void |
setLigRSRnumnbrs(BigInteger value)
Sets the value of the ligRSRnumnbrs property.
|
void |
setLigRSRZ(BigDecimal value)
Sets the value of the ligRSRZ property.
|
void |
setModel(BigInteger value)
Sets the value of the model property.
|
void |
setMogulIgnore(String value)
Sets the value of the mogulIgnore property.
|
void |
setNatomsEDS(BigInteger value)
Sets the value of the natomsEDS property.
|
void |
setNumHReduce(BigInteger value)
Sets the value of the numHReduce property.
|
void |
setOwab(BigDecimal value)
Sets the value of the owab property.
|
void |
setPhi(BigDecimal value)
Sets the value of the phi property.
|
void |
setPsi(BigDecimal value)
Sets the value of the psi property.
|
void |
setRama(String value)
Sets the value of the rama property.
|
void |
setResname(String value)
Sets the value of the resname property.
|
void |
setResnum(BigInteger value)
Sets the value of the resnum property.
|
void |
setRota(String value)
Sets the value of the rota property.
|
void |
setRscc(BigDecimal value)
Sets the value of the rscc property.
|
void |
setRsr(BigDecimal value)
Sets the value of the rsr property.
|
void |
setRsrz(BigDecimal value)
Sets the value of the rsrz property.
|
void |
setSaid(String value)
Sets the value of the said property.
|
void |
setSeq(String value)
Sets the value of the seq property.
|
protected List<AngleOutlier> angleOutlier
protected List<BondOutlier> bondOutlier
protected List<MogAngleOutlier> mogAngleOutlier
protected List<MogBondOutlier> mogBondOutlier
protected BigInteger natomsEDS
protected BigDecimal avgoccu
protected BigInteger ent
protected BigInteger flippableSidechain
protected BigDecimal ligRSRZ
protected BigDecimal ligRSRnbrMean
protected BigDecimal ligRSRnbrStdev
protected BigInteger ligRSRnumnbrs
protected BigInteger model
protected String mogulIgnore
protected BigInteger numHReduce
protected BigDecimal owab
protected BigDecimal phi
protected BigDecimal psi
protected BigInteger resnum
protected BigDecimal rscc
protected BigDecimal rsr
protected BigDecimal rsrz
public ModelledSubgroup()
public List<AngleOutlier> getAngleOutlier()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the angleOutlier property.
For example, to add a new item, do as follows:
getAngleOutlier().add(newItem);
Objects of the following type(s) are allowed in the list
AngleOutlier
public List<Clash> getClash()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the clash property.
For example, to add a new item, do as follows:
getClash().add(newItem);
Objects of the following type(s) are allowed in the list
Clash
public List<BondOutlier> getBondOutlier()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the bondOutlier property.
For example, to add a new item, do as follows:
getBondOutlier().add(newItem);
Objects of the following type(s) are allowed in the list
BondOutlier
public List<MogAngleOutlier> getMogAngleOutlier()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the mogAngleOutlier property.
For example, to add a new item, do as follows:
getMogAngleOutlier().add(newItem);
Objects of the following type(s) are allowed in the list
MogAngleOutlier
public List<SymmClash> getSymmClash()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the symmClash property.
For example, to add a new item, do as follows:
getSymmClash().add(newItem);
Objects of the following type(s) are allowed in the list
SymmClash
public List<MogBondOutlier> getMogBondOutlier()
This accessor method returns a reference to the live list,
not a snapshot. Therefore any modification you make to the
returned list will be present inside the JAXB object.
This is why there is not a set
method for the mogBondOutlier property.
For example, to add a new item, do as follows:
getMogBondOutlier().add(newItem);
Objects of the following type(s) are allowed in the list
MogBondOutlier
public BigInteger getNatomsEDS()
BigInteger
public void setNatomsEDS(BigInteger value)
value
- allowed object is
BigInteger
public String getAltcode()
String
public void setAltcode(String value)
value
- allowed object is
String
public BigDecimal getAvgoccu()
BigDecimal
public void setAvgoccu(BigDecimal value)
value
- allowed object is
BigDecimal
public String getChain()
String
public void setChain(String value)
value
- allowed object is
String
public BigInteger getEnt()
BigInteger
public void setEnt(BigInteger value)
value
- allowed object is
BigInteger
public BigInteger getFlippableSidechain()
BigInteger
public void setFlippableSidechain(BigInteger value)
value
- allowed object is
BigInteger
public String getIcode()
String
public void setIcode(String value)
value
- allowed object is
String
public BigDecimal getLigRSRZ()
BigDecimal
public void setLigRSRZ(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getLigRSRnbrMean()
BigDecimal
public void setLigRSRnbrMean(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getLigRSRnbrStdev()
BigDecimal
public void setLigRSRnbrStdev(BigDecimal value)
value
- allowed object is
BigDecimal
public BigInteger getLigRSRnumnbrs()
BigInteger
public void setLigRSRnumnbrs(BigInteger value)
value
- allowed object is
BigInteger
public BigInteger getModel()
BigInteger
public void setModel(BigInteger value)
value
- allowed object is
BigInteger
public String getMogulIgnore()
String
public void setMogulIgnore(String value)
value
- allowed object is
String
public BigInteger getNumHReduce()
BigInteger
public void setNumHReduce(BigInteger value)
value
- allowed object is
BigInteger
public BigDecimal getOwab()
BigDecimal
public void setOwab(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getPhi()
BigDecimal
public void setPhi(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getPsi()
BigDecimal
public void setPsi(BigDecimal value)
value
- allowed object is
BigDecimal
public String getRama()
String
public void setRama(String value)
value
- allowed object is
String
public String getResname()
String
public void setResname(String value)
value
- allowed object is
String
public BigInteger getResnum()
BigInteger
public void setResnum(BigInteger value)
value
- allowed object is
BigInteger
public String getRota()
String
public void setRota(String value)
value
- allowed object is
String
public BigDecimal getRscc()
BigDecimal
public void setRscc(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getRsr()
BigDecimal
public void setRsr(BigDecimal value)
value
- allowed object is
BigDecimal
public BigDecimal getRsrz()
BigDecimal
public void setRsrz(BigDecimal value)
value
- allowed object is
BigDecimal
public String getSaid()
String
public void setSaid(String value)
value
- allowed object is
String
public String getSeq()
String
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