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The third principle

The iterative algorithms that have been proposed for the reconstruction of structures from insufficient information differ from all other methods because they perform in parallel two distinct reconstructions one for the structure matrix, and one for the so-called memory matrix, i.e. for a matrix where any convenient feature can be stored. This is why these algorithms are collectively referred to as the Memory Reconstruction Method (MRM). [Pg.246]


The third principle relates to the set of equations which describe the potential energy surface of the molecule. These potential energy equations, derived primarily from classical physics, contain parameters optimized to obtain the best match between experimental data and/or theoretical results for a training set of compounds. Once the parameters are evaluated for a set of structures (as diverse as possible), they are fixed and then used unmodified for other similar (and usually larger) compounds. As a first approximation, these parameters must be transferable from one structure to another for this method to work and be generally applicable. [Pg.40]

The third principle observed in designed heme protein systems is that local electrostatics can have a significant impact on the measured heme reduction potential values. The initial heme protein maquette work demonstrated the elevation of heme reduction potentials using local charges, based on both amino acids, Arg+, and adjacent oxidized hemes, [Fe(III)(por)]+. In the case of heme-amino acid electrostatic interactions, Robertson et al. (127) concluded that the presence of an arginine four amino acids removed from the histidine ligand, -HEERL-,... [Pg.437]

The third principle is the Principle of maximum symmetry that plays a major role in deciding between different possible structures as the example given under Rule 11.2 shows. This principle has been previously given as Rule 3.1 ... [Pg.136]

The third principle is that the side chain of Ala can hinder the solvation of NH and CO groups that need to make hydrogen bonds with solvent.35 This is important for the C- and N-termini of the helixes.36 There is an empirical correlation that relates A A GG]y AIa to both AAHP and the difference in solvent-accessible surface area of NH and CO groups in the helix that require solvation (AAHB, — area of Ala-containing helix — area of Gly-containing helix) ... [Pg.274]

The third principle is the principle of attenuation, which consists of using a hazardous material in a safer form. As an example, the use of diphosgene instead... [Pg.244]

So far I have talked primarily about what is being represented on the map and how those referents are represented, that is, about the representational correspondences between the referent and map (see Liben Downs, 1989). But implicit in the discussion of these symbols have been spatial qualities. For example, symbols and referents have been described as linear or as point features, they are said to be placed at various locations on a base map which itself has a particular shape and extent. It is the spatial nature of this information that leads to the third principle of map understanding. [Pg.55]

The third principle applies only to those techniques using diffusion as the motor of the reagents, and is concerned with the immobility or... [Pg.179]

The third principle states that breakage of the material is determined by the flaw structure. This aspect of size reduction has already been discussed. [Pg.3895]

According to Sobell and Sobell (2000, pp. 573-574), in the stepped care approach the selection of any treatment is guided by three principles (1) Treatment should be individualized with regard to the client s needs and problems, (2) tltc treatment selected should be consistent with tlie current knowledge about effectiveness, and (3) the treatment that is chosen should be the least restrictive (considering the physical effects of treatment on the client and the client s lifestyle and resources). A consequence of the third principle is that more-intensive treatments are reserved for more severe problems. [Pg.412]

To the alchemist, the universal life-giving principle within Nature is spirit, while the unique essence of each thing is its soul. These, together with the third principle, the body, form the tria prima. The easiest way to approach this central theme is to turn to the willing guidance of the plant kingdom, whose three principles are easily identified. [Pg.11]

The third principle. Salt, acts as mediator between Sulphur and Mercury. It is the spark between them, the child of the union, the harmonising balancing point of their polarity. [Pg.12]

Paracelsus believed that the material world was ultimately composed of the four Aristotelian elements of Earth, Air, Fire, and Water, but that more immediately it was made up of three substances. These were known as mercury, sulfur, and salt, and were sometimes referred to as the triaprima. They were not the actual substances that we know by these names today, but stood for certain principles. Mercury, also known as the spirit, stood for the principles of fusibility and volatility. Sulfur, which represented the soul, stood for inflammability, and salt, the body, stood for incombustibility and nonvolatility. In this theory Paracelsus had revived an old Arabic idea that metals were formed from a combination of sulfur and mercury. He added the third principle of salt, and extended the definition to include all material substances. [Pg.59]

The first principle is illustrated best in Appendix I. The second principle is best approximated from the ionization potential (IP IE) of the Lewis base HOMO and from the electron affinity (EA) of the Lewis acid LUMO. The third principle will be illustrated in the specific reactions discussed below. [Pg.174]

Thus the third principle simply asserts that, in its motion as a whole, a body does not know whether it is a mixture or not but in this paper the skeleton of the medium consists of a continuum with microstructure, as defined by Capriz (1989), and therefore it must satisfy balance equations there proposed. The first and the second principles affirm that the whole is no more than the sum of its parts and that the mixture s constituents, imagined as splitted in geometry, must be considered united in physics by suitable forces or energies, respectively. We should also notice how, unlike balance equations, constitutive proposals for dependent fields are usually affected by microstructural independent variables in addition to gross ones. [Pg.535]

The latter must be clarified by the third principle (concerning the directedness of the evolution of the biosphere) or the empirical generalisation of J. Dana (1813-1895). This generalisation coimects the evolution of the biosphere to the development of a central nervous system in some species (cephalization) (Vernadsky, 1991, pp. 21, 22). Human reason and a higher level of biospheric organisation are the results of cephalization. [Pg.39]

In ancient Vedic terms, the two pillars B and I representing Mercy in Judgment and Justice, are the first Principle of Creation and Tmth called Brahma and the third Principle of Transformation, Destmction and Regeneration called Shiva. The consummate Pillar of Beauty that represents Liberality is Vishnu, the second Principle of All Pervading Light. [Pg.123]

The third principle of anesthesia is the maintenance of the internal environment of the body. For example, the regulation of electrolytes (sodium, potassium, chloride, magnesium, calcium, etc.), acid-base balance, and a host of supporting functions on which cellular function and organ system communications rest. [Pg.284]

Obviously, the interpretation of these principles is not unique. In this book, we interpret the third principle in the sense that if we neglect the diffusion (relative movement of one constituent towards the others—a phenomenon typical only for the mixture) the mixture must behave as a single substance (then even chemical... [Pg.144]

Literal interpretation [12, 13] of the third principle is that a body does not know if it is a mixture or not which leads to complicated and not fuUy clear expressions in mixture when diffusion is present cf. Rems. 3, 7, 10, 11, see also [60, 67, 68, 73]. [Pg.145]

Unfortunately, so simple a result is not obtainable with other beilances (see Rems. 7, 10, 11) but even here, if aU velocities are the same Va = v, they are in accord with the interpretation of the third principle in Sect. 4.1, cf. Rem. 1. [Pg.149]

Our interpretation of the third principle in Sect. 4.1 is then achieved in non-diffusing mixture with u = o, with the internal eneigy u naturally given by (4.90), (4.22). [Pg.163]


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