Class pmr.chemime.GAMESS
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Class pmr.chemime.GAMESS

java.lang.Object
   |
   +----java.awt.Component
           |
           +----java.awt.Container
                   |
                   +----java.awt.Panel
                           |
                           +----java.applet.Applet
                                   |
                                   +----pmr.simplegraph.SimpleApplet
                                           |
                                           +----pmr.sgml.SGMLApplet
                                                   |
                                                   +----pmr.sgml.SGMLTree
                                                           |
                                                           +----pmr.cml.CMLTree
                                                                   |
                                                                   +----pmr.chemime.ChemTree
                                                                           |
                                                                           +----pmr.chemime.GAMESS

public class GAMESS
extends ChemTree
class to read (? and write?) GAMESS (US) files

NOT COMPLETE

Author:
(C) P. Murray-Rust, 1996

Constructor Index

 o GAMESS(String, StringList)
form a GAMESS object from a local file

Method Index

 o main(String[])
this is only run when an application.
 o process()
 o readDATA()
 o readGRAD()
 o readHESS()
 o readVEC()
 o readVIB()
 o readZMAT()
 o showHelp()
display help

Constructors

 o GAMESS
  public GAMESS(String filename,
                StringList lines) throws BadFileException
form a GAMESS object from a local file
Parameters:
filename - name of file to read from (or title if lines != null)
lines - if lines != null, use this as file content instead of filename
Throws: BadFileException
file was not a standard GAMESS file

Methods

 o showHelp
  public void showHelp()
display help
Overrides:
showHelp in class ChemTree
 o process
  protected void process() throws BadFileException
 o readDATA
  public void readDATA()
 o readZMAT
  public void readZMAT()
 o readVEC
  public void readVEC()
 o readGRAD
  public void readGRAD()
 o readHESS
  public void readHESS()
 o readVIB
  public void readVIB()
 o main
  public static void main(String args[])
this is only run when an application.

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