Dear sir：
Thank you for reading my letter.
I have a few problems in Shell MD
.... . I have set the parameter of Shell MD as the Gromacs manual in my
*.mdp file.
emtol:10.0
niter:20
fcstep:0
But the result is the same with the traditilnal MD.
Whether the Gromacs can not finish Shell MD?
I hope to obtain your help.
Your prompt attention to this letter would be highly appreciated.
Thanks a lot.
Liyan
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