(no subject)

From: Bill Ross <ross_at_cgl.ucsf.edu>
Date: Mon 2 Apr 2001 09:51:45 -0700 (PDT)

        I am studying WAT-residue interactions. I wonder if it is possible to
        write out names of WAT which were in contact (within defined cutoff)
        with RESIDUE XY along trajectory. I noticed that CARNAL CUTRES
        keyword could be appropriate but it writes out all atoms and i
        want only waters.
Look at INH2O and EXH2O in carnal.

Bill Ross
Received on Mon Apr 02 2001 - 09:51:45 PDT
Custom Search