Dear Amber user,
Could anyone suggest me how to run Amber single point calculation in a way
that atoms of solvent are represented only as a point charges (with all
other interactions - bonding and nonbonding - turned off), while in the same
time all interactions of solute atoms are accounted for?
Thanks in advance,
Jura
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Tue Apr 12 2011 - 05:30:03 PDT
