AMBER: shake constraint on all bonds

From: Jian Zhang, Dr <>
Date: Thu, 6 Nov 2003 11:34:24 +0800

Dear amber users,

Could anybody kindly tell me the most appropriate time step
if I set ntc=3, namely, all bonds stretching freedom are removed.

And, could anyone comment on this if I intend to study protein
dynamics in water?

Thank you very much.

J. Zhang ,Dr
Institute of Biophysics
Nanjing University
P. R. China

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Received on Thu Nov 06 2003 - 03:53:01 PST
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