[gmx-users] wrong angle g_hbond in manual?

Pim Schravendijk schraven at mpip-mainz.mpg.de
Mon Sep 13 14:53:12 CEST 2004


Hi all,

The cutoff value for the angle alpha in chapter 8.10 of the manual 

alpha <= 60 degrees (p 162 of 3.2 version manual)

seems to be incorrect, it should be 30 degrees, just as the "acut" value
that is used in the program itself. Or am I missing some logical thinking
step?

Greetings, Pim

--
Pim Schravendijk - PhD Student
Max Planck Institute for Polymer Research
http://www.mpip-mainz.mpg.de/~schraven/




More information about the gromacs.org_gmx-users mailing list