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. Author manuscript; available in PMC: 2022 Nov 3.
Published in final edited form as: Phys Chem Chem Phys. 2011 Mar 9;13(15):6955–6969. doi: 10.1039/c0cp02487b

Figure 5.

Figure 5

The total non-bonded interaction energies (Eelec and EvdW) between the atoms of 5ZNF are given for the simulated systems, (a),(b) separately and (c) as a sum. The respective values for the additionally simulated systems are given in grey.