Re: parameters for Glutathione and BSO

From: felmerino_at_uchile.cl
Date: Thu Sep 09 2010 - 22:32:29 CDT

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Hey,

There is a NAMD tutorial (the topology file tutoriales) which deals with glutathione.

Take a look here

http://www.ks.uiuc.edu/Training/Tutorials/science/topology/topology-html/node5.html

felipe

----Mensaje original----

De: arayasecchi_at_gmail.com

Fecha: 09-09-2010 12:44

Para: <namd-l_at_ks.uiuc.edu>

Asunto: namd-l: parameters for Glutathione and BSO

Drae NAMD users:

Does any one have the CHARMM topology and parameters for Glutathione and/or BSO (buthionine sulfoximine)

Any help will be very appreciated.

Cheers

Raúl Araya Secchi

B.Sc Molecular Biotechnology.
Molecular Biotechnology Engineer.
PhD Student (Biotechnology Program. UNAB, Chile)
Computational Biology Lab (DLab)
Center for Mathematical Modeling (CMM)
Facultad de Ciencias Físicas y Matemáticas.

Universidad de Chile.

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