public class FilterCatalogParams extends CatalogParams
Paramter Class for initializing a FilterCatalog with the specified set of FilterCatalogs. Current catalogs include:
FilterCatalogParams.FilterCatalogs.ALL
FilterCatalogParams.FilterCatalogs.BRENK
FilterCatalogParams.FilterCatalogs.PAINS_A
FilterCatalogParams.FilterCatalogs.PAINS_B
FilterCatalogParams.FilterCatalogs.PAINS_C
FilterCatalogParams.FilterCatalogs.PAINS
FilterCatalogParams.FilterCatalogs.ZINC
Details:
Modifier and Type | Class and Description |
---|---|
static class |
FilterCatalogParams.FilterCatalogs |
swigCMemOwn
Modifier | Constructor and Description |
---|---|
|
FilterCatalogParams() |
|
FilterCatalogParams(FilterCatalogParams.FilterCatalogs catalogs) |
|
FilterCatalogParams(FilterCatalogParams other) |
protected |
FilterCatalogParams(long cPtr,
boolean cMemoryOwn) |
Modifier and Type | Method and Description |
---|---|
boolean |
addCatalog(FilterCatalogParams.FilterCatalogs catalogs) |
void |
delete() |
void |
fillCatalog(FilterCatalog catalog) |
protected void |
finalize() |
SWIGTYPE_p_std__vectorT_RDKit__FilterCatalogParams__FilterCatalogs_t |
getCatalogs() |
protected static long |
getCPtr(FilterCatalogParams obj) |
void |
initFromStream(SWIGTYPE_p_std__istream ss) |
void |
initFromString(java.lang.String text) |
java.lang.String |
Serialize() |
void |
toStream(SWIGTYPE_p_std__ostream ss) |
getCPtr, getTypeStr, setTypeStr
protected FilterCatalogParams(long cPtr, boolean cMemoryOwn)
public FilterCatalogParams()
public FilterCatalogParams(FilterCatalogParams.FilterCatalogs catalogs)
public FilterCatalogParams(FilterCatalogParams other)
protected static long getCPtr(FilterCatalogParams obj)
protected void finalize()
finalize
in class CatalogParams
public void delete()
delete
in class CatalogParams
public boolean addCatalog(FilterCatalogParams.FilterCatalogs catalogs)
public SWIGTYPE_p_std__vectorT_RDKit__FilterCatalogParams__FilterCatalogs_t getCatalogs()
public void fillCatalog(FilterCatalog catalog)
public void toStream(SWIGTYPE_p_std__ostream ss)
toStream
in class CatalogParams
public java.lang.String Serialize()
Serialize
in class CatalogParams
public void initFromStream(SWIGTYPE_p_std__istream ss)
initFromStream
in class CatalogParams
public void initFromString(java.lang.String text)
initFromString
in class CatalogParams