[gmx-users] co-solvent topologies (G53a?)

Nuno R. L. Ferreira nunolf at ci.uc.pt
Thu Oct 21 17:50:43 CEST 2004


Hi

Does anybody have Gromos (G53a?) .itp topology files for methanol (Walser
et. al, JCP 2000) and DMSO (Geerke et al., JPC-B 2004)?

Tryed to build those files, but I have doubts that they are ok.

Regards,
Nuno


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Nuno Ricardo Santos Loureiro da Silva Ferreira
Departamento de Química
Faculdade de Ciências e Tecnologia
Universidade de Coimbra
3004-535 Coimbra - Portugal
Fax: +351 239 827703  - www.biolchem.qui.uc.pt
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