Hi,
I am not sure I understand properly the difference of option of igb=0
and igb=6 in AMBER 9: igb=0 - means no implicit solvation (no GB), igb=6
- pure vacuum. I understand as both gives vacuum in non periodic
systems. So what is the difference? Could anyone give a short comment?
--
Arturas Ziemys, PhD
School of Health Information Sciences
University of Texas Health Science Center at Houston
7000 Fannin, Suit 880
Houston, TX 77030
Phone: (713) 500-3975
Fax: (713) 500-3929
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Received on Sun Jul 13 2008 - 06:07:13 PDT