Hi:
I use ptraj to do H bond analysis. Here is the output I get, I don't
quite understand the %occupied term, the lifetime term and the maxocc
term and those numbers in the parenthesis. Can any one give me some clue
about what they are?
Thanks in advance.
Lishan
DONOR ACCEPTORH ACCEPTOR
atom# :res.atom atom# :res.atom atom# :res.atom %occupied
distance angle lifetime maxocc
| 13868 :869.OE2 | 15697 :976.H7 15696 :976.O2 | 100.00 2.630 (
0.11) 14.49 ( 7.10) 915.0 ( 0.0) 915
|....................|
--
Lishan Yao <yaolisha.pilot.msu.edu>
MSU
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Received on Thu Sep 11 2003 - 21:53:00 PDT
