[CPMD-list] How to compile CPMD with GROMOS96

Yuming Sun symsun69 at yahoo.com.cn
Sat Mar 10 08:15:16 CET 2007


Dear CPMD users,
   
  To perform QM/MM simulations, we got an official GROMOS 96 license. However, when we compiled with -qmmm,  we always got error like "IPO link: can not find "MM_Interface/mm_add_hydrogen.o". We just don't know how to get the MM_interface.
   
  Best regards


Dr. Yuming Sun
Department of Physics
Yantai University
Yantai, Shandong 264005
P.R. China
Tel. 86-535-6904965
Fax  86-535-6901947
 		
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