Hi all,
Actually I want simulate some binary liquid mixture like DMF and
methanol and just want to find diffusion coefficient for each of the
components. But the problem is I am not able to create DMF solvent box. I have
created the .itp and .pdb file of DMF from
http://davapc1.bioch.dundee.ac.uk/prodrg/. I am new to gromacs. If someone
kindly give me some advice, will be helpful for me.
Thanking you
abhishek
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