[gmx-users] Question on [ angles ] in topology file?

Chze Ling Wee chzelingwee at gmail.com
Fri May 4 19:17:52 CEST 2007


Hi GMX users -

In the [ angles ] section of the topology file for a protein, is there a
minimum or maximum angle value that can be specified i.e.

[ angles ]
;  i     j    k     funct   angle  force.c.
1  2  3  1    x  250

Is there a range of values x can take? Can x be negative?

Are x = -90 and x = 270 equivalent?

Cheers
Chze Ling Wee
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