summary on flexible docking - partII
- From: Lim Teck Sin <mcblimts ^at^ leonis.nus.sg>
- Subject: summary on flexible docking - partII
- Date: Sat, 30 Sep 1995 15:08:25 +0800 (SST)
Hi everyone
There are only 2 additional postings on software that perform
flexible docking.(please see summary below)
Best regards - teck sin
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Date: Tue, 12 Sep 1995 09:00:45 +0300
From: "Andreas P. Heiner" <Andrepeter.Heiner ^at^ vtt.fi>
To: mcblimts ^at^ leonis.nus.sg
Subject: soft docking
Dear dr. Sin,
you may want to test the SCULPT-package, which in a way is interactive
flexible docking. For academics relatively cheap (<$USD 2000), you can
obtain a demo-version of it via WWW at http://www.intsim.com/~isigen.
If you get other more info, I would be pleased to stay informed.
Sincerely,
Andrepeter Heiner
=================================================================
| Andreas P. Heiner | voice : +358-0-456 5105 |
| VTT/Biotechnology and | fax : +358-0-455 2103 |
| Food Research | e-mail: andrepeter.heiner ^at^ vtt.fi |
| Biologinkuja 1, Espoo | |
| FIN-02044 VTT Finland | |
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Date: Sat, 16 Sep 1995 19:30:41 -0400
From: "Wayne C. Guida" <wcg ^at^ ussu.Ciba.Com>
To: mcblimts ^at^ leonis.nus.sg
Cc: wcg ^at^ ussu.Ciba.Com
Subject: flexible docking
Dear Teck-sin:
We have used the BatchMin program (available from Columbia
University -
Clark Still's group) for flexible conformational searches in enzyme binding
sites and full flexible docking (positional and conformational sampling)
as well. A pointer to our work appears in a review we have written for
Current Opinion in Structural Biology:
"Software for Structure-based Drug Design", W. C. Guida, Current
Opinion in Structural Biology, 1994, 777-781.
-Wayne C. Guida
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Wayne C. Guida
Pharmaceuticals Division
Ciba
556 Morris Ave.
Summit, New Jersey 07901
Phone: 908-277-7954 FAX: 908-277-2405
Internet:
wcg ^at^ ussu.ciba.com
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