[gmx-users] access code for qmmm

Farzad Molani farzad_c81 at yahoo.com
Sat Nov 14 13:42:39 CET 2009

I'm going to study reactions mechanism for enzymes. I want to use gromacs 
for qmmm calculations. I read Gerrit Groenhof's access code for qmmm. I have some questions about Groenhof's code:
1- After compileing this code,Does QM package (for example Gaussian 03) need to modify ?
2- Does this code implement in Gromacs 4.0?
Thanks in advance.

Farzad Molani,
Ph.D Student,
Department of Theoretical Chemistry and Biochemistry,
K. N. Toosi University of Technology,
Tehran, Iran.
Tel.: 009821 2306 4280=20
Fax: 009821 2285 3650=20
Web: http://www.kntu.ac.ir

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