molpro.el

[Peter Knowles]

Jochen, as I promised really a long time ago, we have set up (I hope)
a CVS repository for molpro.el.
cvs -d :pserver:jochen at molpro.bham.ac.uk:/usr/local/cvsroot login
passowrd is the same as yours for Molpro's bugzilla
checkout molpro.el
You should see the version you posted to molpro-user. I have also put
this on the web server.
Please complain if I got it wrong somehow.
Thanks for your efforts on this; one day I or someone else round here
will be sufficiently up to speed on elisp to do some more!
Peter

At 23 Aug 2002 00:38:29 -0400,
Jochen Küpper wrote:
> 
> [1  <text/plain; iso-8859-15 (quoted-printable)>]
> I post an updated version of molpro.el, a major mode to edit MOLPRO
> files and start calculations.
> 
> The main improvement is the ability to start MOLPRO jobs under LSF.
> 
> ,----[Changelog]
> | 2002-08-23  Jochen Küpper  <jochen at jochen-kuepper.de>
> | 
> | 	* release: 2.0
> | 
> | 	* molpro.el (molpro-run-lsf): Allow specification of empty queue and
> | 	host.  That is, if the variables are empty strings (""), the options
> | 	are not given to bsub at all.
> | 
> | 2002-08-22  Jochen Küpper  <jochen at jochen-kuepper.de>
> | 
> | 	* molpro.el (molpro-run-lsf): Added this function to start job under
> | 	LSF control.
> | 	(molpro-comment), (molpro-lsf-host), (molpro-lsf-queue),
> | 	(molpro-lsf-option):  Add these cusomization options.
> | 	Add run-lsf and run-nqs to XEmacs menu.
> | 
> | 2002-05-01  Jochen Küpper  <jochen at jochen-kuepper.de>
> | 
> | 	* molpro.el: Put in X11 license so P. Knowles can take a look at it.
> | 	(molpro-show-output-buffer): Change viper-current-state only if it is
> | 	is 'vi'.
> | 	(molpro-font-lock-keywords): More keywords.  Logical operators.
> | 	Labels.
> | 	(molpro-update-output-buffer): New function.
> | 	(molpro-show-output-buffer): Bind molpro-update-output-buffer to 'u' in
> | 	view-mode. New otional parameter to define the input-file for which to
> | 	show output.  Remove molpro-output-buffer.  Rename molpro-input-buffer
> | 	-> ib, ob -> buffer, and of -> file.  Make ib and ob local variables.
> `----
> 
> Greetings,
> Jochen
> -- 
> University of North Carolina                       phone: +1-919-962-4403
> Department of Chemistry                            phone: +1-919-962-1579
> Venable Hall CB#3290 (Kenan C148)                    fax: +1-919-843-6041
> Chapel Hill, NC 27599, USA                            GnuPG key: 44BCCD8E
> [2  <application/emacs-lisp (quoted-printable)>]
> 

--
Prof. Peter J. Knowles              
Email P.J.Knowles at bham.ac.uk  Phone +44-121-414-7472  Fax +44-121-414-7471
School of Chemical Sciences, University of Birmingham, Birmingham, B15 2TT, UK
WWW http://www.tc.bham.ac.uk/~peterk/