Dear Amber Users,
I am trying to combine 908 pdb files into one mdcrd file. So far I was't
successful with this process. I am not processing all of the sets into
mdcrd file.
I get final result like this
PTRAJ: Successfully read in 908 sets and processed 1 sets.
Dumping accumulated results (if any)
last few input file lines to ptraj is
trajin bc9.pdb.33.new 907 1 907
trajin bc9.pdb.58.new 908 1 908
trajout centroid20.mdcrd mdcrd
I believe there is some missing element to last line 'trajout' part but I
cannot find what is wrong with it.
any help will be greatly appreciated.
Kim
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Received on Mon Jun 11 2012 - 16:00:04 PDT
