AMBER Archive (2007)Subject: AMBER: fragment parametrization tutorial?
From: Miguel Ortiz-Lombardía (ibdeno_at_gmail.com)
Date: Sat Sep 29 2007 - 13:53:05 CDT
Dear amber users,
I want to carry out binding free energy calculations for a system where one
protein contains a non-standard residue, N(6)-acetyl-lysine. Since I haven't
been able to locate parameters for such residue, I'd like to try and
generate them myself. Being quite new to AMBER, I'd appreciate if someone
could point me to a tutorial for this kind of procedure within AMBER.
Thanking you in advance for your help,
Miguel
--
correo-e: ibdeno_at_gmail.com
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Je suis de la mauvaise herbe,
Braves gens, braves gens,
Je pousse en liberté
Dans les jardins mal fréquentés!
Georges Brassens
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