[gmx-users] Dynamics with positions restrained

Tanos C. C. França tccf at epq.ime.eb.br
Sun Apr 27 17:07:01 CEST 2003


            Dear users,
            Is that possible to perform, using GROMACS, a MD in a
protein with all residues except the ones of the active site
restrained?????  If so, could someone teach us how to proceed to achieve
that???????
            Thanks a lot in advance.
            Tanos C. C. França
            IME – Rio de Janeiro - Brazil

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