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Modeling of other

Chemical compounds can also be represented by chemical data, or even by biological data. In fact, Briem et al. have used the results of a battery of biological assays to represent a compound for the modeling of other biological data [62-64]. [Pg.431]

The same dispersion procedures were used for modeling of other point sources but since only prototype sources were addressed, population data were required only for prototypical conditions in each geographic region. Prototypical population was represented by the average population density in the urbanized areas of each region, since nearly all sources treated by prototype were located in urban areas. [Pg.79]

Liquid chromatography (LC) and, in particular, high performance liquid chromatography (HPLC), is at present the most popular and widely used separation procedure based on a quasi-equilibrium -type of molecular distribution between two phases. Officially, LC is defined as a physical method... in which the components to be separated are distributed between two phases, one of which is stationary (stationary phase) while the other (the mobile phase) moves in a definite direction [ 1 ]. In other words, all chromatographic methods have one thing in common and that is the dynamic separation of a substance mixture in a flow system. Since the interphase molecular distribution of the respective substances is the main condition of the separation layer functionality in this method, chromatography can be considered as an excellent model of other methods based on similar distributions and carried out at dynamic conditions. [Pg.167]

The first rigorous method for weak electrolyte solutions was that of Edwards et al. ( 5). Because comparisons with the models of other workers will be made, the thermodynamic framework will be outlined and the assumptions that were made stated. For a single solute which dissociates only in the aqueous solution, the model is based on four principles ... [Pg.51]

Difference Fourier techniques are most useful in locating sites in a multisite derivative, when a Patterson map is too complicated to be interpretable. The phases for such a Fourier must be calculated from the heavy-atom model of other derivatives in which a difference Patterson map was successfully interpreted, and should not be obtained from the derivative being tested, in order not to bias the phases. Also, difference Fourier techniques can be used to test the correctness of an already identified heavy-atom site by removing that site from the phasing model and seeing whether it will appear in... [Pg.93]

Advancements in crystallography/NMR techniques have resulted in an exponential increase in the number of protein structures in publicly available structural databases (e.g., as of September 2009, the Protein Database Bank PDB contains experimentally solved 3D structural data for 60,000 structures (www.pdb.org)). In addition, several structural genomics consortiums aim to provide crystal structures across all protein families (38). In case when experimental structures are not available, techniques such as homology modeling are often used to build structural models of other homologous proteins (21). [Pg.157]

Important for the validity of the models that we constructed is the evidence from models of other proteins indicating that two proteins can have as little as 20 to 25% sequence identity and still have very similar 3D structures, especially in a helices and [3 stands [49-52]. Variation is found in the loops and coiled structures. A relevant example for this chapter is the comparison of the tertiary structure of rat dihydropteridine reductase [33] and Streptomyces hydrogenans 20(3-hydroxysteroid dehydrogenase [34]. As noted by Varughese et al. [33], despite less than 20% sequence identity between dihydropteridine reductase and... [Pg.197]

The tertiary structure of HLADH, the representing enzyme of this group, was refined to 2.4 A resolution with X-ray diffraction [102 105], and the three-dimensional modeling of other medium-chain ADHs is based upon this structure [106, 107], The tertiary structure of yeast ADH was found to be similar to that of HLADH although the primary structure of YADH is quite different. [Pg.156]

The atomic coordinates from these structures are nowadays the basis of the new computational and NMR spectroscopic studies aimed at the derivation of binding models of other drugs. Therefore, we will describe the main features of tubulin structures in the next section. [Pg.92]

As may be apparent from many of the examples presented above, models of processes that affect the fate and transport in groundwater of petroleum hydrocarbons and chlorinated aliphatic hydrocarbons are much more prevalent than models of other contaminants. Much research has yet to be accomplished to improve our understanding and ability to model transformation processes, particularly for contaminants like polynuclear aromatic hydrocarbons, nitro-aromatics, and pesticides. [Pg.59]

These kinds of advances in control implementation in turn bring new life to efforts to develop detailed models of other polymerization reactions, since it is no longer such a major leap to on-line implementation. Efforts to model emulsion polymerization and heterogeneous Ziegler-Natta polymerization are among the most ambitious [26-28], Fundamental modeling efforts on... [Pg.333]

Numerous structural classes of potassium ion channels have been discovered. The six transmembrane domain proteins include voltage-gated channels (Kv), and Ca2+ activated K+ channels (Kca). However, there are also proteins with 2 transmembrane domains and 7 transmembrane domains [3]. The most widely studied potassium channel of relevance to toxicity and therefore the interests of the pharmaceutical industry to date appears to be Kv 11.1, the human ether-a-go-go-related gene (hERG), as is described in more detail below. Some computational modeling of other potassium channels is also addressed. [Pg.354]

As more information has become known about the structure of the atom, scientists have developed new models. Making your own model and studying the models of others will help you learn how protons, neutrons, and electrons are arranged in an atom. Can an element be identified based on a model that shows the arrangement of the protons, neutrons, and electrons of an atom How will your group construct a model of an element that others will be able to identify ... [Pg.26]

Residual Discriminant For situations where the data collected are not described well by PC models of other faults but will be within the residual threshold of their own class, it is most likely that x is from the fault model i with minimum... [Pg.183]

The present degree of specialization has resulted in a condition of intellectual isolationism. This manifests itself in. inability to see. .. relevance of content, methods and models of other. .. disciplines, existence of an inbred. . . philosophy. . . largely irrelevant to. .. problems of modern life."... [Pg.8]

Ten suggested approaches to managing stress include the following worry only about things over which you have control, include physical exercise as part of your routine, have hobbies and destimulating activities in which you can lose yourself, plan ahead, avoid negative self-talk, rename the events that are stressful to you, build a support system, be decisive, put the situation into perspective, and use role models of others who have succeeded. [Pg.1283]

Models of other possible vectors of dispersion (e.g., water, food, and transportation). [Pg.11]

All of these recent CA models qualitatively or quantitatively illustrate the importance of nucleophilicity of zinc(II)-bound OH species in aqueous or nonaqueous solutions. This aspect is important in almost all of the zinc enzymes and will be presented again for models of other hydrolytic enzymes. However, in CA and many other zinc enzymes, the basicity of the zinc(II)-bound hydroxide is similarly important. Although I offers an excellent CA model, its catalytic activity is moderate in comparison to CK. Model 1 simply shows the essence of the intrinsic properties of zinc (II) at the active center of CA. Other important features such as the hydrophobic pocket for CO2, proton relay (network), and other structures in... [Pg.182]

This chapter has focused on equilibrium and non-equilibrium models of electrolyte solutions around biomolecules. However, the Wei group has also extended this formalism to the multiscale modeling of other systems and biological processes. One class of multiscale models developed in the Wei group is a DG-based quantum treatment of proton transport [133,134]. Proton transport... [Pg.444]

In the same manner, sensitivity component models can be obtained for the other bond graph elements. As junctions do not depend on parameters they remain junctions in a sensitivity pseudo bond graph. Sources that provide a constant become sources of value zero. Sensitivity component models of other elements differ from their element only by additional sinks. As a result, a sensitivity pseudo bond graph is of the same structure as the behavioural system bond graph. Moreover, causalities of the latter one are retained. [Pg.142]


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Behavior of Other Model Elastomers

Catalysis by micelles, membranes and other aqueous aggregates as models of enzyme

Catalysis by micelles, membranes and other aqueous aggregates as models of enzyme action

Enzyme action, catalysis of micelles, membranes and other aqueous aggregates as models

Other Aspects of Protein Modeling

Other Forms of Chemical Transport Models

Other Kinds of Macromolecular Models

Other Modelling Aspects of Catalytic Membrane Reactors

Other Models of Charge Generation and Transport

Other Modern Models Behavioural Adaptation in the Face of Assistance

Other limitations of crystallographic models

Other models for nucleation and growth of compact nuclei

Other prediction models of asphalt stiffness

Van der Waals and Other Model Equations of State

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