>> Hello, dear users! >> >> I want to study different components in total free energy. >> Could you tell me in what gromacs program and in what place exactly force and energy are calculated?
>I think your question is too general. I don't know whether you've already done a calculation, are planning one, or want to look at source code. Please ask a more specific question. > >Mark I've already run md and I've got a pmf. Bun I want to split this pmf into several, each of which corresponds to different components of total force or energy. So I want to look at source code and try to change them or is another way to do this? Petr.
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