AMBER Archive (2004)

Subject: AMBER: IBELLY

From: Harianto (harianto_at_mailer.sb.fsu.edu)
Date: Tue Nov 09 2004 - 14:40:58 CST

Hi,
I need to know whether I made it properly.
The following is group information to do minimization using ibelly=1
and I only want to keep all heavy atoms fixed, and let all hydrogen
atoms be movable. The protein is not solvated, no water. For example,
the protein has res 1 - 100.
=>

Fix heavy atom
FIND
* H * *
SEARCH
RES 1 100
END
END

If any body knows how to do it, please help me.
Thanks alot.
Harianto.

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