Hi
I have a metal and want to keep a water molecule and a ligand nearby. I
would like to use the
makeDIST_RST -ual 8col.wc -pdb no_water.pdb -rst rst.dis
but when I use it I get the following error
# makeDIST_RST
Currently configured for up to 5000 atoms
Using MAP file /home/amber10/dat/map.DG-AMBER
ERROR no map function for O WAT :data= 399 WAT O 211 HIC
ZN 2.0 2.8
I have still not solvated my complex is it possible to use these restraints
with more than 5000 atoms I am a little puzzled on the up to 5000 statement
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Received on Wed Oct 06 2010 - 11:30:03 PDT
