public class MMFF94BasedParameterSetReader extends Object
Constructor and Description |
---|
MMFF94BasedParameterSetReader()
Constructor for the MM2BasedParameterSetReader object
|
Modifier and Type | Method and Description |
---|---|
List<IAtomType> |
getAtomTypes() |
Map<String,Object> |
getParamterSet() |
void |
readParameterSets()
The main method which parses through the force field configuration file
|
void |
setInputStream(InputStream ins)
Sets the file containing the config data
|
public MMFF94BasedParameterSetReader()
public void setInputStream(InputStream ins)
ins
- The new inputStream type InputStream