[gmx-users] Steered MD in gromacs

hanna pdb gpcr5000 at hotmail.com
Tue Sep 3 17:22:28 CEST 2013

Dear all,

I am just starting MD simulations and wanted to see how to perform steered molecular dynamics in gromacs . Most papers and tutorials that I found were done in NAMD. Can anyone recommend examples that were done in gromacs?  In my case the tutorial " Pull Code and Umbrella Sampling" on the gromacs website seems not applicable. I "simply" want to see how to perform an in vacuo simulation by pulling.

Thank you in advance!!


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