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Modeling systems model-building

Assisted model building with energy refinement (AMBER) is the name of both a force field and a molecular mechanics program. It was parameterized specifically for proteins and nucleic acids. AMBER uses only five bonding and nonbonding terms along with a sophisticated electrostatic treatment. No cross terms are included. Results are very good for proteins and nucleic acids, but can be somewhat erratic for other systems. [Pg.53]

Sahlin P. Modeling and simulation methods for modular continuous systems in buildings. Stockholm Royal Institute of Technology, 1996. [Pg.1104]

Jones TA. A graphics model building and refinement system for macromolecules. JAppl Cryst 1918 11 268. [Pg.298]

The modelization of whole systems like buildings with a storage integrated or with building components that include PCM can be done using Esp-r or TRNSYS. [Pg.290]

The design procedures depend heavily on the dynamic model of the process to be controlled. In more advanced model-based control systems, the action taken by the controller actually depends on the model. Under circumstances where we do not have a precise model, we perform our analysis with approximate models. This is the basis of a field called "system identification and parameter estimation." Physical insight that we may acquire in the act of model building is invaluable in problem solving. [Pg.8]

It is clear that the ultimate solution rests with the ISO tests used as a part of a European Classification System adopted as a part of a common or model building code for the European Community. [Pg.481]

Extension has a number of typical uses. It is used for defining a component spec from a business model and for defining variations. In the first case, the component model builds on the definitions of the business model. So once you ve read the Networking requirements, you know not only what a LineCircuit is but also how to point at one in your software system. [Pg.319]

Build2-3. Refine it to specify the system by building its local type model of the domain the retrieval mapping is defined top-down. [Pg.533]

Pattern 15.9, Using State Charts in System Type Models Building state charts of specification types is a useful cross check for completeness and uncovers missing cases of actions and effects. [Pg.553]

Capture collaborations with and around an object, component, or system, by building a context model, showing all abstract actions (use-cases) involving the system. [Pg.612]

This paper reflects the past activities of some of its authors in computer modeling of the chemical aspects of biological systems. This activity requires expertise in both model-building and in the relevant biology. It also involves examination of the actions of and results obtained by experts, like that routinely done in building expert systems. It also involves keeping track of and coherently explaining sequences of decisions, which expert systems are equipped to do. [Pg.76]

With this background infonnation on the inverse methods, it is instructive to examine the calculations for the inverse model in more detail. In Equation 5-23, the key to the model-building step is the inversion of the matrix CR ). This is a squire matrix with number of rows and columns equal to the number of measurement variables (nvars). From theory, a number of independent samples in the calibration set greater than or equal to nvars is needed in order to invert this matrix. For most analytical measurement systems, nvars (e.g., number of wavelengths) is greater than the number of independent samples and therefore RTr cannot be directly inverted. However, with a transformation, calculating she pseudo-inverse of R (R is possible. How this transformation is accomplished distinguishes the different inverse methods. [Pg.130]

One of the over-arching goals of physical chemistry is to explain real systems by building upon what we know about ideal systems and examining the limitations of those idealized models. The study of real gas behavior using Virtual Substance is one of the most eye-opening assignments for the students. [Pg.200]

Rapid prototyping (or stereolithography or 3D object curing) is a photochemical process used to produce solid 3D objects such as models, masters or patterns of any shape, directly from a design generated on a computer. The computer is used to control the illumination system that builds up the object, usually by a rapid polymerization process. An important part of the design is that the object is sectioned... [Pg.141]

Engineers commonly use dimensionless ratios such as the Reynolds number and the lift coefficient to help understand complex experimental data, organize equations and model building, and relate model testing in a wind tunnel to that of a prototype flight. This kind of analysis is called dimensional analysis because it uses the dimensional nature of important variables to derive dimensionless parameters that determine the scaling properties of a physical system. [Pg.182]

One further point of interest concerning Klebsiella K5 is that the 0-acetyl groups appear to have little effect on the helix stability. X-ray diffraction patterns taken of de-acetylated material showed that the pitch and type of helix were both identical to those for the acetylated material and further, model building of a deacetylated chain gave rise to the same backbone conformation and system of hydrogen bonds (10). [Pg.433]

The construction of a mass balance model follows the general outline of this chapter. First, one defines the spatial and temporal scales to be considered and establishes the environmental compartments or control volumes. Second, the source emissions are identified and quantified. Third, the mathematical expressions for advective and diffusive transport processes are written. And last, chemical transformation processes are quantified. This model-building process is illustrated in Figure 27.4. In this example we simply equate the change in chemical inventory (total mass in the system) with the difference between chemical inputs and outputs to the system. The inputs could include numerous point and nonpoint sources or could be a single estimate of total chemical load to the system. The outputs include all of the loss mechanisms transport... [Pg.497]


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See also in sourсe #XX -- [ Pg.46 , Pg.49 ]




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