On Tue, Dec 16, 2008, Taufik Al-Sarraj wrote:
>
> Is it possible to have a distance restraint (fix a bond or two) during a
> minimization?
Set nmropt=1, and follow the instructions in Section 6.1, "Distance, angle and
torionsal restraints." Some sample inputs are on pp. 193-194 of the Users'
Manual.
...dac
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Received on Wed Dec 17 2008 - 01:21:16 PST
