sarbani chattopadhyay wrote:
hi,
I want to know that in what situation does the initial velocity to
the starting structure is to
be kept at zero.
Please note that you may want to use the velocities in a gro file as
starting velocities. In that case, you must use gen_vel = no, otherwise
new random velocities are generated.
cheers, Jochen
thanks in advance
sarbani
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--
************************************************
Dr. Jochen Hub
Max Planck Institute for Biophysical Chemistry
Computational biomolecular dynamics group
Am Fassberg 11
D-37077 Goettingen, Germany
Email: jhub[at]gwdg.de
Tel.: +49 (0)551 201-2312
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