MM-Radii for QMMM
Kristof
kristof... at googlemail.com
Thu Mar 12 13:34:33 UTC 2015
Hi all,
I am trying to set up a QMMM simulation, for which I will need the covalent
radii for the electrostatic coupling.
I found some old mails in this list that mentioned a "covalent_radii.pl"
script that is supposed to yield those. It is supposed to be in the files
section of this group.
However, I cannot find it (I can't find the files section for that matter),
can someone please help me out?
Best,
Kristof
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