AMBER Archive (2009)

Subject: [AMBER] using ptraj

From: Molecular Dynamics (amberquestion_at_yahoo.com)
Date: Mon Feb 16 2009 - 14:31:42 CST

Dear All,

Is it possible to extract a snapshot ( coordinates, box size and alpha, beta gamma angles information  ) with velocity information from any Amber trajectory files with ptraj and saving this like a restart file ?

Regards,

        hasEML = false;
    

      
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