[gmx-users] g_hbond

Yuguang Mu ygmu at theochem.uni-frankfurt.de
Wed Oct 9 13:25:39 CEST 2002


Dear Everyone,
In using g_hbond, can I  define some special atom types or names as HB doner 
or acceptors, by default, the g_hbond only knows O, N, OH, NH.

Is it possible ?

Yuguang



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