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. Second, unlike hard-sphere potentials, which stipulate that all sterically allowed conformations are isoenergetic, soft-core potentials encode the requisite conformational specificity (48,53,58)
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. The wave numbers used in the calculations range from q = 0 to q = 0
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. The Colorocs toner has melted and coated individual fibers; no toner film is visible in the SEM, while the solvent dye is clearly present on the fibers, as seen in the OM picture (reproduced here in black and white; the dye is a red color and can be clearly seen in the color originals)
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. For most of the peaks in the histograms, the peak position (E^sup peak^) from these fits is a good approximation for the mean E for the peak, due to their fairly symmetric shapes
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. Recomendations With regard to evolution of the API, we recommend that such protocols return relationship information with all calls
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