AMBER Archive (2006)

Subject: AMBER: h-bond

From: Gustavo Pierdominici Sottile (gsottile_at_unq.edu.ar)
Date: Fri Jan 27 2006 - 08:59:07 CST

Dear list,
            I would like to know if the units of lifetimes when analizing
hbond with ptraj are ps.

atom#:res_at_atom atom#:res_at_atom atom# :res_at_atom %occupied distance angle
lifetime maxocc
732 :51_at_CJ | 734 :51_at_HJ2 1022 :70_at_OD2 | 14.41 2.998 ( 0.09)
20.52 ( 7.61) 1.5 ( 0.9)

Moreover I would like to know how it is calculated, since it surprises me
that the information about the frequency of the sampling is not needed or is
read from the trajectory file

Thanks in advance
Gustavo

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