public class SDWriter extends MolWriter
swigCMemOwn
Modifier | Constructor and Description |
---|---|
protected |
SDWriter(long cPtr,
boolean cMemoryOwn) |
|
SDWriter(java.lang.String fileName) |
|
SDWriter(SWIGTYPE_p_std__ostream outStream) |
|
SDWriter(SWIGTYPE_p_std__ostream outStream,
boolean takeOwnership) |
Modifier and Type | Method and Description |
---|---|
void |
close() |
void |
delete() |
protected void |
finalize() |
void |
flush() |
protected static long |
getCPtr(SDWriter obj) |
boolean |
getForceV3000() |
boolean |
getKekulize() |
static java.lang.String |
getText(ROMol mol) |
static java.lang.String |
getText(ROMol mol,
int confId) |
static java.lang.String |
getText(ROMol mol,
int confId,
boolean kekulize) |
static java.lang.String |
getText(ROMol mol,
int confId,
boolean kekulize,
boolean force_V3000) |
static java.lang.String |
getText(ROMol mol,
int confId,
boolean kekulize,
boolean force_V3000,
int molid) |
static java.lang.String |
getText(ROMol mol,
int confId,
boolean kekulize,
boolean force_V3000,
int molid,
Str_Vect propNames) |
long |
numMols() |
void |
setForceV3000(boolean val) |
void |
setKekulize(boolean val) |
void |
setProps(Str_Vect propNames) |
void |
write(ROMol mol) |
void |
write(ROMol mol,
int confId) |
protected SDWriter(long cPtr, boolean cMemoryOwn)
public SDWriter(java.lang.String fileName)
public SDWriter(SWIGTYPE_p_std__ostream outStream, boolean takeOwnership)
public SDWriter(SWIGTYPE_p_std__ostream outStream)
protected static long getCPtr(SDWriter obj)
public static java.lang.String getText(ROMol mol, int confId, boolean kekulize, boolean force_V3000, int molid, Str_Vect propNames)
public static java.lang.String getText(ROMol mol, int confId, boolean kekulize, boolean force_V3000, int molid)
public static java.lang.String getText(ROMol mol, int confId, boolean kekulize, boolean force_V3000)
public static java.lang.String getText(ROMol mol, int confId, boolean kekulize)
public static java.lang.String getText(ROMol mol, int confId)
public static java.lang.String getText(ROMol mol)
public void setForceV3000(boolean val)
public boolean getForceV3000()
public void setKekulize(boolean val)
public boolean getKekulize()