mirror of
https://github.com/openbabel/openbabel.git
synced 2026-08-26 13:17:16 -05:00
Update website to openbabel.org (long overdue).
This commit is contained in:
+1
-1
@@ -1,7 +1,7 @@
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||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+2
-2
@@ -6,7 +6,7 @@
|
||||
# Some portions Copyright (c) 2002 by Geoffrey R. Hutchison
|
||||
#
|
||||
# This file is part of the Open Babel project.
|
||||
# For more information, see <http://openbabel.sourceforge.net/>
|
||||
# For more information, see <http://openbabel.org/>
|
||||
#
|
||||
# This program is free software; you can redistribute it and/or modify
|
||||
# it under the terms of the GNU General Public License as published by
|
||||
@@ -51,7 +51,7 @@ if( !$debug ) {
|
||||
print "/***************************************************************\n";
|
||||
print "This file is part of the Open Babel project.\n";
|
||||
print "This is copyright under the GNU General Public License (GPL)\n";
|
||||
print "For more information, see <http://openbabel.sourceforge.net/>\n\n";
|
||||
print "For more information, see <http://openbabel.org/>\n\n";
|
||||
print "This file contains a binary representation of data tables\n";
|
||||
print " used by Open Babel. It is used as a fallback if the textual\n";
|
||||
print " data table is not found at runtime. It is not a normal header.\n";
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
+1
-1
@@ -1,7 +1,7 @@
|
||||
/***************************************************************
|
||||
This file is part of the Open Babel project.
|
||||
This is copyright under the GNU General Public License (GPL)
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This file contains a binary representation of data tables
|
||||
used by Open Babel. It is used as a fallback if the textual
|
||||
|
||||
@@ -61,6 +61,6 @@ output without saving it by not selecting an output file or by checking "Output
|
||||
<strong>oxamide.cml</strong> which is 2D and has a large number of properties that will be seen when converting to sdf.<br />
|
||||
<strong>FourSmallMols.cml</strong> which (unsurprisingly) contains four molecules with no atom coordinates and can be used to illustrate the handling of multiple molecules. Setting the output format to smi (which is easy to see), you can convert only the second and third molecules by entering 2 and 3 in the appropriate option boxes. Or convert only molecules with C-O single bonds by entering CO in the SMARTS option box.</p>
|
||||
<hr />
|
||||
<p>Please report bugs or suggestions for improvement to the <a href="http://openbabel.sourceforge.net/wiki/Main_Page\n\n\">OpenBabel website</a>.</p>
|
||||
<p>Please report bugs or suggestions for improvement to the <a href="http://openbabel.org/wiki/Main_Page\n\n\">OpenBabel website</a>.</p>
|
||||
</body>
|
||||
</html>
|
||||
|
||||
@@ -4,7 +4,7 @@ example.cpp - example of interfacing of OpenBabel with Boost Graph Library
|
||||
Copyright (C) 2007 by Gerde Menche
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ mol_graph.h - interface with Boost Graph Library.
|
||||
Copyright (C) 2007 by Gerde Menche
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ verbose_visitors.h - visitor classes dumping a short text message for every visi
|
||||
Copyright (C) 2007 by Gerde Menche
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2003 by Michael Banck
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -7,7 +7,7 @@ Some portions Copyright (C) 2003 by Michael Banck
|
||||
Some portions Copyright (C) 2008 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ bondtyper.h - Bond typer to perceive connectivity and bond orders/types.
|
||||
Copyright (C) 2003-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2007-2008 by Tim Vandermeersch
|
||||
<tim.vandermeersch@gmail.com>
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ canon.h - Canonical labeling.
|
||||
Craig A. James
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2008 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2010 by Geoffrey Hutchison
|
||||
Some portions Copyright (C) 2009 by Frank Peters
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2009 by Tim Vandermeersch
|
||||
Some portions Copyright (C) 2009 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2009 by Tim Vandermeersch
|
||||
Some portions Copyright (C) 2009 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ svgpainter.h - Rendering in SVG
|
||||
Copyright (C) 2009 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ descriptor.h - Base class for molecular descriptors
|
||||
Copyright (C) 2007 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ dlhandler.h - Dynamic loader for file format modules.
|
||||
Copyright (C) 2004-2005 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ fingerprint.h - Base class for fingerprints and fast searching
|
||||
Copyright (C) 2005 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ forcefield.h - Handle OBForceField class.
|
||||
Copyright (C) 2006-2007 by Tim Vandermeersch <tim.vandermeersch@gmail.com>
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2004-2007 by Chris Morley
|
||||
Some portions Copyright (C) 2005-2007 by Geoffrey Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2010 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ graphsym.h - Class for handling graph symmetry.
|
||||
Craig A. James
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some Portions Copyright (C) 2008 by Marcus D. Hanwell
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -7,7 +7,7 @@ griddata.h - Store grids of data linked to a molecule (e.g. Gaussian cube)
|
||||
Some Portions Copyright (C) 2008 by Marcus D. Hanwell
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -8,7 +8,7 @@ Copyright (C) 2007 by Tim Vandermeersch
|
||||
Original version: JOELib2, http://joelib.sf.net
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2003 by Michael Banck
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2010 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -2,7 +2,7 @@
|
||||
Copyright (C) 2005 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ lineend.h - Stream buffer for filtering line endings, converting \r or \r\n -> \
|
||||
Copyright (C) 2007 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ locale.h - Handle internal numeric locale issues -- parse data in "C"
|
||||
Copyright (C) 2008 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ align.h - Align two molecules or vectors of vector3
|
||||
Copyright (C) 2010 by Noel M. O'Boyle
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2006 by Benoit Jacob
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ spacegroup.h - Handle Crystallographic Space Groups.
|
||||
Copyright (C) 2007 by Jean Bréfort
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or
|
||||
modify it under the terms of the GNU General Public License as
|
||||
|
||||
@@ -4,7 +4,7 @@ transform3d.h - Handle 3D transformations in space groups.
|
||||
Copyright (C) 2007 by Jean Bréfort
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or
|
||||
modify it under the terms of the GNU General Public License as
|
||||
|
||||
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2006 by Benoit Jacob
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2007,2008 by Sergei V. Trepalin sergey_trepalin@chemical-block.com
|
||||
Copyright (C) 2007,2008 by Andrei Gakh andrei.gakh@nnsa.doe.gov
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -7,7 +7,7 @@ Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2003 by Michael Banck
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ obconversion.h - Handle file conversions. Declaration of OBFormat, OBConversion
|
||||
Copyright (C) 2004-2009 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2002 by Stefan Kebekus
|
||||
Some portions Copyright (C) 2003-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ obmolecformat.h - Subclass of OBFormat for conversion of OBMol.
|
||||
Copyright (C) 2005 Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
@@ -54,7 +54,7 @@ namespace OpenBabel {
|
||||
|
||||
This class is not intended for direct use outside of Open Babel, unless
|
||||
you're writing a new format converting to or from an OBMol molecule.
|
||||
(e.g., see http://openbabel.sourceforge.net/wiki/HowTo:Add_A_New_File_Format).
|
||||
(e.g., see http://openbabel.org/wiki/HowTo:Add_A_New_File_Format).
|
||||
|
||||
An OBFormat which converts to and/or from OBMol can derive from this class
|
||||
to save duplicating the ReadChemObject() and/or WriteChemObject() methods.
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ op.h - plugin options or operations
|
||||
Copyright (C) 2007 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -3,7 +3,7 @@ optransform.h: makes option to transform molecule as specified in a datafile
|
||||
Copyright (C) 2008 Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ plugin.h - facilitates construction of plugin classes
|
||||
Copyright (C) 2007 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1996, 2003 S. Patchkovskii, Serguei.Patchkovskii@sympatico.ca
|
||||
Some portions Copyright (C) 2007 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2010 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ reaction.h - Handle chemical reactions (i.e., lists of reagents and products).
|
||||
Copyright (C) 2005 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 2001, 2002 OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2000 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2000 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Spectrophore.h - Spectrophore(TM) calculator.
|
||||
Copyright (C) 2005-2010 by Silicos NV
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2009-2010 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2009 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2009 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@
|
||||
Copyright (C) 2009 by Tim Vandermeersch
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ text.h - Declaration and Implementation of OBText
|
||||
Copyright (C) 2008 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2005 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -7,7 +7,7 @@ other language that runs on the JVM such as Jython or JRuby.
|
||||
|
||||
The Open Babel wiki pages on Java give information on compiling and
|
||||
running Java programs with Open Babel:
|
||||
http://openbabel.sourceforge.net/wiki/Java
|
||||
http://openbabel.org/wiki/Java
|
||||
|
||||
*** Linux Compilation
|
||||
|
||||
|
||||
+1
-1
@@ -48,7 +48,7 @@ COPYRIGHT AND LICENSE
|
||||
Copyright (C) 2005-2007 Geoffrey R. Hutchison <babel@geoffhutchison.net>
|
||||
|
||||
This Perl Module is part of the Open Babel project.
|
||||
<http://openbabel.sourceforge.net/>
|
||||
<http://openbabel.org/>
|
||||
|
||||
Open Babel is distributed under the GNU General Public License (GPL).
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
|
||||
@@ -5,7 +5,7 @@ g/TR/xhtml1/DTD/xhtml1-transitional.dtd">
|
||||
<title>Open Babel: Python Scripting</title>
|
||||
<meta http-equiv="Content-Type" content="text/html; charset=ISO-8859-1" />
|
||||
|
||||
<link rel="top" href="http://openbabel.sourceforge.net/" />
|
||||
<link rel="top" href="http://openbabel.org/" />
|
||||
<link rel="stylesheet" href="site.css" type="text/css" media="all" />
|
||||
</head>
|
||||
<body bgcolor="#ffffff">
|
||||
@@ -97,7 +97,7 @@ obConversion.WriteFile(mol, '1abc.mol2')
|
||||
</pre>
|
||||
|
||||
<p>
|
||||
That's it! There's more information on particular calls in the <a href="http://openbabel.sourceforge.net/api/">library API</a>. Feel free to address questions to the <a href="mailto:openbabel-scripting@lists.sourceforge.net">openbabel-scripting</a> mailing list.
|
||||
That's it! There's more information on particular calls in the <a href="http://openbabel.org/api/">library API</a>. Feel free to address questions to the <a href="mailto:openbabel-scripting@lists.sourceforge.net">openbabel-scripting</a> mailing list.
|
||||
</p>
|
||||
|
||||
</div> <!-- end content -->
|
||||
|
||||
@@ -15,7 +15,7 @@ conversion framework OBConversion.
|
||||
|
||||
For more details, tutorials, example code, etc., please visit the Open Babel
|
||||
website:
|
||||
<http://openbabel.sourceforge.net/wiki/Python>
|
||||
<http://openbabel.org/wiki/Python>
|
||||
|
||||
INSTALLATION
|
||||
|
||||
@@ -45,7 +45,7 @@ Copyright (C) 2005-2007 Geoffrey R. Hutchison <babel@geoffhutchison.net>
|
||||
Some portions Copyright (C) 2006-2009 Noel O'Boyle
|
||||
|
||||
This Python module is part of the Open Babel project.
|
||||
<http://openbabel.sourceforge.net/>
|
||||
<http://openbabel.org/>
|
||||
|
||||
Open Babel is distributed under the GNU General Public License (GPL).
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
|
||||
+2
-2
@@ -12,7 +12,7 @@ chemistry, solid-state materials, biochemistry, or related areas.
|
||||
This code was automatically generated with SWIG and provides access to almost all of the Open Babel API via Ruby.
|
||||
|
||||
More details can also be found at the Open Babel website:
|
||||
<http://openbabel.sourceforge.net/wiki/Ruby/>
|
||||
<http://openbabel.org/wiki/Ruby/>
|
||||
|
||||
=== INSTALLATION ===
|
||||
|
||||
@@ -81,7 +81,7 @@ Copyright (C) 2007 Geoffrey R. Hutchison <babel@geoffhutchison.net>
|
||||
and Richard L. Apodaca <rich_apodaca@yahoo.com>
|
||||
|
||||
This Ruby module is part of the Open Babel project.
|
||||
<http://openbabel.sourceforge.net/>
|
||||
<http://openbabel.org/>
|
||||
|
||||
Open Babel is distributed under the GNU General Public License (GPL).
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
|
||||
+3
-3
@@ -4,7 +4,7 @@ OBGUI.cpp - Implementation of a cross-platform Graphical User Interface
|
||||
Copyright (C) 2006 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
@@ -461,9 +461,9 @@ void OBGUIFrame::OnAbout(wxCommandEvent& WXUNUSED(event))
|
||||
{
|
||||
wxString msg(_T("OpenBabelGUI (C) 2006 by Chris Morley\n\nThis program is part of\
|
||||
the OpenBabel project,\nwhich is released under the GNU General Public License.\n\
|
||||
See: http://openbabel.sourceforge.net/wiki/Main_Page\n\n\
|
||||
See: http://openbabel.org/wiki/Main_Page\n\n\
|
||||
For more detailed information see:\n\
|
||||
http://openbabel.sourceforge.net/wiki/Windows_GUI\n\n \
|
||||
http://openbabel.org/wiki/Windows_GUI\n\n \
|
||||
OpenBabel version "));
|
||||
msg << _T(BABEL_VERSION);
|
||||
wxMessageBox(msg, _T("About OpenBabelGUI"), wxOK | wxICON_INFORMATION | wxCENTER, this);
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ OBGUI.h - Cross-platform Graphical User Interface
|
||||
Copyright (C) 2006 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ optswx.cpp - Constructs wxWidgets Option controls from description text
|
||||
Copyright (C) 2006 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ optswx.h - Constructs wxWidgets Option controls from description text
|
||||
Copyright (C) 2006 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ OBGUI.h - Cross-platform Graphical User Interface
|
||||
Copyright (C) 2006 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ RDKitConv.cpp - Convert OpenBabel OBMol to RGKit molecules
|
||||
Copyright (C) 2007 by Chris Morley
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -6,7 +6,7 @@ Some portions Copyright (C) 2001-2008 by Geoffrey R. Hutchison
|
||||
Some portions Copyright (C) 2003 by Michael Banck
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -5,7 +5,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -4,7 +4,7 @@ bondtyper.cpp - Bond typer to perceive connectivity and bond orders/types.
|
||||
Copyright (C) 2003-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -5,7 +5,7 @@ Copyright (C) 2007-2008 by Tim Vandermeersch
|
||||
<tim.vandermeersch@gmail.com>
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -6,7 +6,7 @@ canon.h - Canonical labeling.
|
||||
Craig A. James
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -7,7 +7,7 @@ Copyright (C) 1998-2001 by OpenEye Scientific Software, Inc.
|
||||
Some portions Copyright (C) 2001-2006 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
+1
-1
@@ -5,7 +5,7 @@ Copyright (C) 2010 Geoffrey Hutchison
|
||||
Some portions Copyright (C) 2009 by Frank Peters
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
@@ -4,7 +4,7 @@ gasteiger.cpp - A OBChargeModel to handle Gasteiger sigma charges
|
||||
Copyright (C) 2010 by Geoffrey R. Hutchison
|
||||
|
||||
This file is part of the Open Babel project.
|
||||
For more information, see <http://openbabel.sourceforge.net/>
|
||||
For more information, see <http://openbabel.org/>
|
||||
|
||||
This program is free software; you can redistribute it and/or modify
|
||||
it under the terms of the GNU General Public License as published by
|
||||
|
||||
Some files were not shown because too many files have changed in this diff Show More
Reference in New Issue
Block a user