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. 2015 Jul 13;112(30):9270–9275. doi: 10.1073/pnas.1511780112

Fig. 2.

Fig. 2.

MD simulation results. Potentials of mean force W for PS20 as a function of the radius of gyration Rg (A), normalized so that 0exp(W(Rg)/kBT)dRg=1, and along the end-to-end distance L (B), normalized so that 04πL2exp(W(L)/kBT)dL=1. (C) Force vs. end-to-end distance profile of different LJ polymer in the gas phase using steered MD simulation. We average over the force at the plateau region to compute the unfolding force. (D) Scaling of plateau force with degree of polymerization for the gas-phase LJ chain and the corresponding power law fits. Data are shown for two different pulling rates but, irrespective of the pulling rate, the results are well fitted by a power law of F=aNb with b=0.27.