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As the ripples flatten at increasing strain, the energetic term due to C C bonds stretching competes with the entropic contribution, followed by energetic dominant deformation.
This result means that, besides strain-related nucleation mechanisms, another energetic term that takes into account also curvature-related considerations in the selective nucleation of InAs material [19] has to be considered.
The second energetic term lumps over the total deformation energy of the membrane.
Namely, the energetic term will dominate at sufficiently low temperatures while the entropic term will dominate at higher temperatures.
This simplification is justified by arguing that the conformational entropy of the native state is negligible and, therefore, the energetic term must be the dominant factor favoring the native state and the energy minimum should be equivalent to the free energy minimum.
It should be mentioned that the terminal domain models may well be overly compact, because of the energetic term in the Rosetta force field that favors compactness.
Similar(48)
Considering the scoring functions, Surflex is mostly based on empirical energetic terms [30].
The other energetic terms not directly related to motion have been evaluated according to Chester.
However, the entropic and energetic terms of ternary blends were more favorable for miscibility than those of binary blends.
The method combines pharmacophore perception and database screening with protein ligand energetic terms computed by the Glide XP scoring function to rank the importance of pharmacophore features.
The calculations revealed multiple stable, complex conformations and changes in p38α and inhibitor conformations, as well as balance in several energetic terms and configurational entropy loss.
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