<div>My apologies if this question is rather elementary, but we are uncertain what the units of partial charge are in GROMACS (i.e. in library files like ffG43a1.rtp) - we are assuming they are units of elementary charge (
i.e. charge of one electron/proton = 1)</div>
<div> </div>
<div>Thank-you.</div>
<div> </div>
<div>-Travis Trudeau</div>