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Marginal case

Model optimization is a further refinement of the secondary and tertiary structure. At a minimum, a molecular mechanics energy minimization is done. Often, molecular dynamics or simulated annealing are used. These are frequently chosen to search the region of conformational space relatively close to the starting structure. For marginal cases, this step is very important and larger simulations should be run. [Pg.189]

The presence of condensation in confined spaces, such as the turns of a coil or stacked sheets, can cause a more severe staining accompanied by a thick bloom. Oiling or the use of interleaving is sometimes successful in preventing this damage in marginal cases, but improved storage conditions or the elimination of crevice conditions are preferable. [Pg.666]

The causal approach is undeveloped. Fear is the only emotion we are dose to understanding at the neurophysiological level (LeDoux 19%). We do not know if other emotions have similar neural pathways. The relation between, say, parental love and fear may turn out to be like the relation between whales and sharks. Because of our lack of understanding of the core emotions, we should keep an open mind about the borderline cases. When more is known about the neurobiological substrates, some of the marginal cases may move to the center, and vice versa. [Pg.243]

It is known that the correspondence principle suggested by N. Bohr (1923) postulates that any theory pretending for better description and broader application range than the older one must include the latter in the form of marginal case . [Pg.36]

The succession of theoretical notions may be shown by using the corresponding principle for consideration of the chemical interference theory as a more general concept of interrelated and interacting reactions. The correspondence principle applied to the interference of chemical reactions must represent a postulate, which in the marginal case of the determinant (D —> v) requires the coincidence of its chemical consequences with yields of usual chemical reactions, e.g. classical stoichiometric reaction. [Pg.36]

Show that, in marginal cases, data may be non-significant when assessed by a two-sided test, andyetbesignificantwith the one-sided version of the same test... [Pg.117]

In marginal cases, results that are not significant when tested with a two-sided test may just achieve statistical significance if re-tested with a one-sided test. [Pg.123]

Figure 4 shows the dependence of the numerical value of q on the ratio Na/N0. Each point in the Figure represents the relation between the numerical values of q and the corresponding numerical value of the ratio Na/N0, both calculated for each of the analysed twenty-eight kinetics, by the procedure explained. The numerical value of q tends to 3 when the numerical value of the ratio Na/N0 tends to zero (FJa- 0), and this a marginal case in which zeolite is formed by the growth of nuclei-I only. In this case, the kinetics of crystallization can be expressed by the first term of Equation (2),... [Pg.118]

Since cut strategy II is only the marginal case of cut strategy I and since the application of cut strategy I provides more flexibility and often leads to a better global optimum, only cut strategy I will be used for model-based optimization in this chapter. [Pg.331]

Thus, from the point of view of stability, the marginal cases are those where at least one eigenvalue satisfies Re(A) = 0,... [Pg.154]

Solution The multiplier at x = 0 is / (O) = cos(O) = 1, which is a marginal case where linear analysis is inconclusive. However, the cobweb of Figure 10.1.2 shows that x = 0 is locally stable the orbit slowly rattles down the narrow channel, and heads monotonically for the fixed point. (A similar picture is obtained for... [Pg.351]

Marginal cases can be resolved, either by improving risk estimation, by collecting more or better information, or by reviewing the risk evaluation framework. [Pg.53]

For d = 4, exclusion effects appear, but we see that in this case, v must remain equal to 1/2. Thus, the case d = 4 is a marginal case. [Pg.87]

Aromatic and sterically restricting aliphatic aldehydes in marginal cases lead to retro-oxaphosphetane ring opening [53]. Reversibility has also been excluded as a significant process for semi-stable and stable ylides [43,54]. Therefore, the stereochemistry of the salt-free Wittig reaction would be established in virtually all cases by the formation of cis- or rraw5-oxaphosphetanes under kinetic control. [Pg.87]

It would be in very unusual circumstances that expensive solvents (e.g. THF) would not be recovered even when the recovery costs are high. Cheap solvents, such as the hydrocarbons, are also cheap to recover after AC adsorption, unless the odour of the recovered solvent presents a problem. Methanol, usually the cheapest of all the solvents, needs straightforward fractionation after desorption from AC, but will often prove a marginal case for recovery. [Pg.120]


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See also in sourсe #XX -- [ Pg.243 ]




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