Dipole Cooperativity and Polarization Frustration Determine the Secondary Structure Distribution of Short Alanine Peptides in Water.

J Phys Chem B · 2023 · PMC10108861 · PMID 36848625

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an interesting trendno p-value reported

An interesting trend in Figure 4 is that Δ E COSMO can be approximated with a quadratic function of the form 5 where μ is the DFT dipole of the solute computed without COSMO.

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