Modifier and Type | Class and Description |
---|---|
class |
QueryCachedResults<T> |
class |
QueryCachedResultsBoolean
Returns results of a previously executed query (e.g.
|
class |
RetrieveStructureImagePath
Cached images
|
Modifier and Type | Class and Description |
---|---|
class |
ReadDatasetRelation
Similar to
ReadStructureRelation , but retrieves the related compounds for the entire dataset |
class |
ReadStructureRelation |
Modifier and Type | Class and Description |
---|---|
class |
AbstractStructureRetrieval<R>
Retrieve structures, given a chemical or structure ID.
|
class |
ReadChemicalIds |
class |
RetrieveAtomContainer |
class |
RetrieveDatasets |
class |
RetrieveDescriptor |
class |
RetrieveField<ResultType> |
class |
RetrieveFieldPropertyValue
Retrive property-value pairs
|
class |
RetrieveFieldStructure
Retrieve property value pairs and assign to a structure record
|
class |
RetrieveGroupedValuesByAlias |
class |
RetrieveModelTemplates<ResultType>
Retrieves property values given a model
|
class |
RetrieveModelTemplatesPropertyValue
Retrieves property values given a model
|
class |
RetrieveProfileValues |
class |
RetrieveProfileValuesAsRow |
class |
RetrieveStructure |
class |
RetrieveTemplate<ResultType> |
class |
RetrieveTemplatePropertyValue
Retrieves properties by given template
|
class |
RetrieveTemplateStructure |
Modifier and Type | Class and Description |
---|---|
class |
DictionaryObjectQuery |
class |
DictionaryQuery<T extends Dictionary> |
class |
DictionarySubjectQuery |
class |
QueryExperiment<T,C extends net.idea.modbcum.i.IQueryCondition,ResultType> |
class |
QuerySmilesByID |
class |
QueryUser
Searches in users table
|
Modifier and Type | Class and Description |
---|---|
class |
AbstractPropertyRetrieval<F,T,C extends net.idea.modbcum.i.IQueryCondition> |
class |
FreeTextPropertyQuery
Same as
FreeTextQuery , but retrieves properties |
class |
ModelTemplates |
class |
PropertiesByDataset
Retrieves Property-es used by particular dataset
|
class |
PropertiesByQuery |
class |
PropertyCount |
class |
PropertyRange
Returns binned range of property (defined by Fieldname), number of bins is given by setValue()
|
class |
PropertyStatsNumeric |
class |
PropertyStatsString |
class |
QueryMetricRange |
class |
QueryOntology |
class |
QueryPairwiseTanimoto
Generatise pairwise similarities between structures in given datasets
|
class |
QueryPairwiseTanimotoAndProperty
Similar to
QueryPairwiseTanimoto , but returns also property values |
class |
RetieveFeatures
Given
IStructureRecord , find if its properties are already in the properties table. |
class |
RetrieveFieldNames |
class |
RetrieveFieldNamesByAlias
Finds properties by alias
|
class |
RetrieveFieldNamesByType
Retrieve names of string properties if setValue(0) ;
real valued properties if setValue(1)
int properties if setValue(2)
|
class |
RetrieveProfile |
class |
TemplateQuery |
Modifier and Type | Class and Description |
---|---|
class |
QueryConsensus |
class |
QueryQLabel |
Modifier and Type | Class and Description |
---|---|
class |
AbstractStructureQuery<F,T,C extends net.idea.modbcum.i.IQueryCondition> |
class |
ChemicalByQueryFolder
Retrieves chemicals from set of datasets, defined in the query table
restricted by sessions.title
|
class |
FingerprintsByStatus |
class |
FreeTextQuery
select idchemical,metric from
(
(select idchemical,2 as metric from properties join property_values using(idproperty)
join property_string using(idvalue_string) join structure using(idstructure)
where name like "MA%" and value like "Reaction%"
)
union
(select idchemical,2 as metric from properties join property_values using(idproperty)
join property_string using(idvalue_string) join structure using(idstructure)
where value like "MA%" and name like "Reaction%"
)
union
(select idchemical,1 as metric from properties
join property_values using(idproperty) join structure using(idstructure) where name like "MA%")
union
(select idchemical,1 as metric from property_values
join property_string using(idvalue_string) join structure using(idstructure) where value like "MA%")
union
(select idchemical,1 as metric from properties
join property_values using(idproperty) join structure using(idstructure) where name like "Reaction%")
union
(select idchemical,1 as metric from property_values
join property_string using(idvalue_string) join structure using(idstructure) where value like "Reaction%")
) a
|
class |
MissingFingerprintsQuery |
class |
MissingInChIsQuery |
class |
NumberQuery<F> |
class |
QueryAtomEnvironment
Similarity via atom environment matrix
/query/similarity?search=c1ccccc1O&threshold=0.5&mode=ae
|
class |
QueryByIdentifierWithStructureFallback
Calls findByProperty stored procedure
|
class |
QueryDataset
src_dataset.name = ?
|
class |
QueryDatasetByID |
class |
QueryDistance
Distance between two atoms, provided as symbols.
|
class |
QueryExactStructure
Deprecated.
Convert to InChI and use
QueryStructure |
class |
QueryField
Search for a structure with property with given name and value
|
class |
QueryFieldAbstract<T,C extends net.idea.modbcum.i.IQueryCondition,NC extends net.idea.modbcum.i.IQueryCondition> |
class |
QueryFieldMultiple |
class |
QueryFieldNumeric |
class |
QueryFunctionalGroups |
class |
QueryLookupStructure
This is a wrapper around
QueryStructure , allowing to use IStructureRecord as a parameter |
class |
QueryMissingDescriptor
reads structures, for each there are / or there are not (depending on getCondition) descriptors with given idname and reference title.
|
class |
QueryMissingDistances
Reads structures without precalculated pairwise atom distances from the database.
|
class |
QueryMissingProperty |
class |
QueryPrescreenBitSet
First bitset is from structural keys, second from fingerprints
|
class |
QuerySimilarity<F,T,C extends net.idea.modbcum.i.IQueryCondition> |
class |
QuerySimilarityBitset
Tanimoto similarity of
BitSet . |
class |
QuerySimilarityStructure |
class |
QuerySMARTS
Select structures by querying fungroups table by smarts
|
class |
QueryStoredResults |
class |
QueryStoredResultsByName
Retrieve structure collections from query table by name and folder (sessions table)
|
class |
QueryStructure
Search for smiles, inchi, formula
|
class |
QueryStructureByID
Selects a structure by idstructure
|
class |
QueryStructureByQuality |
class |
QueryStructureByQualityPairLabel |
class |
QueryStructureByValueQuality |
class |
QueryStructureType |
class |
QueryStrucType |
class |
ScopeQuery
A convenience class for a query used to restrict the scope of other queries
|
Modifier and Type | Class and Description |
---|---|
class |
QueryStructureByProperty<Q extends AbstractStructureQuery> |
class |
QueryStructureByPropertyInCompounds |
class |
QueryStructureByPropertyInDataset |
class |
QueryStructuresByPropertyInResults |
Modifier and Type | Class and Description |
---|---|
class |
ChemicalSpaceQuery |
class |
QueryStructurePairs<Dataset1,Dataset2>
returns idstructure of two molecules
|
class |
QueryStructurePairsDataset
Selects a structure by idstructure
|
class |
QueryStructurePairsMixed |
class |
QueryStructurePairsRDataset |
class |
RetrieveStructurePair |
Modifier and Type | Class and Description |
---|---|
class |
QueryQMap
Reads
QMap |
class |
QueryQMapSpace
Reads
QMapSpace |
class |
QueryQMapStructures |
Modifier and Type | Class and Description |
---|---|
class |
AbstractReadSubstance<F,T> |
class |
FacetedSearchSubstance |
class |
ReadByReliabilityFlags |
class |
ReadSubstance |
class |
ReadSubstanceByExternalIDentifier |
class |
ReadSubstanceByName |
class |
ReadSubstanceByOwner
All substance given an owner name or UUID
|
class |
ReadSubstanceByStudy |
class |
ReadSubstanceByType |
class |
ReadSubstances
Retrieve set of substances given array of substance UUIDs
|
Modifier and Type | Class and Description |
---|---|
class |
ReadSubstanceIdentifiers |
Modifier and Type | Class and Description |
---|---|
class |
ChemicalBySubstanceRelation
Returns all chemicals which are component of a substance.
|
class |
ReadSubstanceComposition |
class |
ReadSubstanceRelation
Reads all structures, related to the query substance via substance_relation table
|
Modifier and Type | Class and Description |
---|---|
class |
ReadEffectRecord
Reads effects records given document uuid
|
class |
ReadEffectRecordAbstract<F,ER extends EffectRecord<String,String,String>> |
class |
ReadEffectRecordBySubstance |
class |
ReadSubstanceProperty |
class |
ReadSubstanceStudy<PA extends ProtocolApplication<Protocol,String,String,IParams,String>> |
Modifier and Type | Class and Description |
---|---|
class |
ReadAnnotation |
class |
ReadBookmark
Bookmark
|
Modifier and Type | Class and Description |
---|---|
class |
ReadBundle
Retrieve
SourceDataset by id |
class |
ReadBundleVersion |
Modifier and Type | Class and Description |
---|---|
class |
ReadChemicalsByBundle |
Modifier and Type | Class and Description |
---|---|
class |
ReadEffectRecordByBundle |
Modifier and Type | Class and Description |
---|---|
class |
ReadEndpointsByBundle |
Modifier and Type | Class and Description |
---|---|
class |
ReadEffectRecordByBundleMatrix |
Modifier and Type | Class and Description |
---|---|
class |
ReadSubstanceChemicalsUnionByBundle |
class |
ReadSubstancesByBundle |
class |
ReadSubstancesByBundleCompounds
Retrieve substances, containing compounds defined by the /bundle/id/compound
|
Modifier and Type | Class and Description |
---|---|
class |
AbstractReadDataset<T,M extends ISourceDataset> |
class |
DatasetQueryFieldGeneric<T,C extends net.idea.modbcum.i.IQueryCondition> |
class |
DatasetQueryFieldNumeric |
class |
DatasetQueryFieldString |
class |
QueryDatasetByFeatures |
class |
ReadDataset
Retrieve
SourceDataset by id |
class |
ReadDatasetLicense
Retrieve
SourceDataset by id |
Modifier and Type | Class and Description |
---|---|
class |
QueryFingerprints
Expects 1024 bit fingerprint in the form of "0-0-0-0-0-20000000-0-0-0-0-0-0-0-0-0-10000000" (16x 64 bits)
|
class |
ReadStructuresByFingerprint |
Modifier and Type | Class and Description |
---|---|
class |
AbstractModelQuery<F,V> |
class |
QueryModel |
class |
ReadModel
ModelQueryResults
|
Modifier and Type | Class and Description |
---|---|
class |
ReadProperty
Reads
Property by id |
Modifier and Type | Class and Description |
---|---|
class |
ReadPropertyAnnotations |
Modifier and Type | Class and Description |
---|---|
class |
ReadQueryFolder
Retrieve query folder header by id or name
|
Modifier and Type | Class and Description |
---|---|
class |
ReadReference
Retrieve references (by id or all)
|
Modifier and Type | Class and Description |
---|---|
class |
ReadStoredQuery |
class |
SearchStoredQueries |
Modifier and Type | Class and Description |
---|---|
class |
ChemicalByDataset
idchemical by dataset
|
Modifier and Type | Class and Description |
---|---|
class |
DBVersionQuery |
Modifier and Type | Class and Description |
---|---|
class |
QueryEditor<F,T,C extends net.idea.modbcum.i.IQueryCondition,ResultType,Q extends AbstractQuery<F,T,C,ResultType>> |
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