From: Ramin Ekhteiari (ramin_ekh_at_yahoo.com)
Date: Fri Apr 04 2014 - 15:08:04 CDT
Hi,
Would you please let me know the algorithm used by NAMD code for restraining the bonds involving hydrogen atoms, is it SHAKE or RATTLE algorithm?
So appreciated for any advice
Cheers,
Ramin.
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