On Sat, 27 Apr 2013 11:01:42 -0600, Daniel Roe wrote:
> Hi,
>
> On Sat, Apr 27, 2013 at 9:01 AM, miguel
> <miguel.ortiz-lombardia.afmb.univ-mrs.fr> wrote:
>> I wonder if there is a way to reproduce the ptraj option 'print' of
>> the
>> hbond command with the latest version of cpptraj (AmberTools13). The
>
> Unfortunately not at this time. The 'cut' option is there so that
> 'lifetime' analysis can be used on more than just hbond series (e.g.
> so you could use it on generic distance data sets). An equivalent to
> the 'print' option may be added in a future update.
>
I see, thank you Dan.
That would be useful, especially combined with the excellent new
possibility of producing input files for gnuplot.
Cheers,
--
Miguel
Architecture et Fonction des Macromolécules Biologiques (UMR7257)
CNRS, Aix-Marseille Université
Case 932, 163 Avenue de Luminy, 13288 Marseille cedex 9, France
Tel: +33(0) 491 82 55 93
Fax: +33(0) 491 26 67 20
e-mail: miguel.ortiz-lombardia.afmb.univ-mrs.fr
Web: http://w2.afmb.univ-mrs.fr/Miguel-Ortiz-Lombardia
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Received on Sun Apr 28 2013 - 01:00:03 PDT
