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Stephen Constable authored
This is the initial commit of my work in getting OpenMM GROMACS support improved to the point where SMOG SBM simulations run out-of-the-box. Further commits will be code cleanup.
30fc8eb1
This is the initial commit of my work in getting OpenMM GROMACS support improved to the point where SMOG SBM simulations run out-of-the-box. Further commits will be code cleanup.