[gmx-users] sw water problem

[Rongliang Wu]

Hello gmx-users,
              i used grompp intending to minimize the SW water i made, but i get error like:
Fatal error:
Found a second defaults directive, file "/home/wurl/gromacs/share/gromacs/top/sw.itp", line 36


              i looked in sw.itp file but line 36 is:
[ defaults ]
LJ	Geometric 

              do i have to remove "geometric"?

Thanks!

Regards!
                    
Sincerely,

Rongliang Wu
State Key Laboratory
of Polymer Physics and Chemistry
Center of Molecular Science
Institute of Chemistry
Chinese Academy of Sciences
 				

　　　　　　　　　　wurl04 at iccas.ac.cn
　　　　　　　　　　2006-01-13