[gmx-developers] topology and bfact problem

Martin Höfling martin.hoefling at gmx.de
Fri Feb 9 11:55:22 CET 2007


Hi all,

sth is wrong with this construct:

top.atoms.pdbinfo[ndx].bfac=0.5;

top is:
t_topology top;

and already initialized, at least calculations based on the read out mass is 
working. Do i need to initialize the pdbinfo separately?

Cheers
	Martin

--
Man kann die Relativitätstheorie auf vieles anwenden. Auf das Usenet
auch, aber dann sind die Ergebnisse fürchterlich falsch.
(Nico Hoffmann in dnq)



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