[Users-list] Protein interchain energies
Nuno R. L. Ferreira
nunolf at ci.uc.pt
Tue Nov 1 02:32:32 CET 2005
Hi *
First time on this mailing list.
A newbie question, about the GRID capabilities.
I have a set of similar models of a dimer of proteins. Think on them has 2
cylinders, side by side along the main cylinder axis. From electrostatics
calculations (Grasp) I know that there's a surface segregation of charged
residues.
Is it possible to calculate with GRID an interchain energy for each model, in
order to calculate which of them is the most stable, in terms of
electrostatics and VDW clashes?
Best regards,
--
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Nuno Ricardo Santos Loureiro da Silva Ferreira
Ph.D student
Grupo de Química Biológica
Departamento de Química
Faculdade de Ciências e Tecnologia
Universidade de Coimbra
3004-535 Coimbra
Portugal
www.biolchem.qui.uc.pt
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\" Do not worry about your dificulties in mathematics.
I can assure you that mine are still greater.\"
e=mc2
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