The title pretty much says it all. I am working off of the Bevan Lab GROMACS Tutorial written by Dr. Justin Lemkul. I am not new to gromacs but I am trying to refresh myself on running the simulations.
Thanks,
JW
Short of writing your own program, this is the only mechanism in GROMACS to solvate. That's why the program is named as it is.
If you do not want to use genbox you can use the program packmol
http://www.ime.unicamp.br/~martinez/packmol/
You can use editconf, and in some way specify the position of each solvent particle. But why dont you want to use genbox or solvate?
Hi, why don`t you use these tools? there is some drawback?
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