Hi, all gmx-users, I am simulating the surfactant on the liquid/liquid interface. After reading a lot of paper, I predefine the different potential function forms for these three parts (surfactant, water, CCl4). For water model, I used the SPC model; for CCl4, I used the function form from gromo96; for surfactant, the bond stretching and angle bending potentials are harmonic, and proper dihedrals potential is from Fourier function. I want to know whether the different potential functions combined are suitable? That is to say, is it the rule on the different potential functions combined? I hope for your help. Thanks a lot! H. Y. Xiao
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