Re: Problems with Mutator1.1, mutations and FEP

Date: Tue Oct 02 2007 - 08:51:30 CDT


Thanks for the fast replys. Yes I used the psf given by the plugin. Here are the links for my psf and the vmd console output:

As you can see alchemify was actually applied.

The angle CT1 C CT2 is not in the parameter file. It is physically not reasonable anyway. How can I prevent or remove these angles?

Thanks in advance Sven

Psssst! Schon vom neuen GMX MultiMessenger gehört?
Der kanns mit allen:

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