On 6/29/12 4:48 AM, reising...@rostlab.informatik.tu-muenchen.de wrote:
Hi everybody,
I want to put my protein in a box with the command:
editconf -f 3m71.gro -o 3m71_box.gro -c -bt dodecahedron -d 1.0 2>>logErr
1>>logOut
and add solvent afterwards with:
genbox -cp 3m71_box.gro -cs spc216.gr
Hi everybody,
I want to put my protein in a box with the command:
editconf -f 3m71.gro -o 3m71_box.gro -c -bt dodecahedron -d 1.0 2>>logErr
1>>logOut
and add solvent afterwards with:
genbox -cp 3m71_box.gro -cs spc216.gro -p 3m71.top -o 3m71_water.gro
2>>logErr 1>>logOut
But when I look at it I
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