I would only add that much of the software development is done as a "hobby" by many 
us, i.e. with only grudging institutional support.
Bob


-----Original Message-----
From: L. Cranswick [mailto:[EMAIL PROTECTED]
Sent: Fri 3/19/2004 3:44 PM
To: [EMAIL PROTECTED]
 

[hope this is not a resend - Email software went beserk with
previous effort]

>"What happens in the future?" When Bob Von Dreele and Brian Toby, to
>name two, join Al Larson in retirement, (and Al finally stops working)
>what happens then? 

A number of single crystal members on the IUCr Commission on
Crystallographic Computing have been quite concerned about this as well
(their observations being based on the field of small molecule
crystallography).

A result of these concerns is putting renewed effort into the IUCr
computing schools. (next one is in Siena in 2005 - just prior
to the IUCr Florence congress)

   http://www.iucr.org/iucr-top/comm/ccom/siena2005/

The Siena School webpage states:
  "The aim of the school is to have the crystallographic computing experts
  of the present, help train and inspire a new generation of experts in
  crystallographic computing."

As well as IUCr Computing Commission newsletters for publishing software
crystallographic programming information and help with community building.

   http://www.iucr.org/iucr-top/comm/ccom/newsletters/

-------

>I will be very interested in your responses. Is my prediction of coming
>disaster too pessimistic? Probably. After all, the late Jose Donnay of
>Johns Hopkins University always claimed that crystallography was ruined by
>the invention of the computer. I never learned to what extent his opinion
>was effected by the conflicts I had with his wife.

Overall, I am not as pesimistic on this issue: as we have seen
analytical software gaps get filled once they have become too annoying
to kludge solutions from existing software packages. Examples of this
could be the recent advances in powder indexing software to handle
impurity peaks, new or updated software for structure solution from
powder diffraction data, and new advances in fundamental parameters
based Rietveld packages.

One old-school Prof in London stated the personal opinion that black
button that is Direct Methods (1960's?) wrecked the fun and challenge in
solving crystal structures from single crystal data. This does not seem
the case in solving structures from powders? The black buttons are not
yet that routine(?) Though programs like EXPO and Fox are working well
in that direction.

Lachlan.

-----------------------
Lachlan M. D. Cranswick
Contact outside working hours /
  Coordonnees en dehors des heures de travail:
E-mail / courriel: [EMAIL PROTECTED]   Home Tel: (613) 584-4226
Mobile/Cell: 613 401 3433   WWW: http://lachlan.bluehaze.com.au/
        P.O. Box 2057, Deep River, Ontario, Canada, K0J 1P0

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