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. Author manuscript; available in PMC: 2019 Feb 13.
Published in final edited form as: J Chem Theory Comput. 2018 Jan 9;14(2):948–958. doi: 10.1021/acs.jctc.7b00948

Figure 1.

Figure 1.

The logarithm of the magnitude of the force discontinuities present when only potential shifting is used to smooth the potential, as a function of κ and rcut. Parameters for various atom types are taken from the C36 lipid FF.