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High-dimensional

Pratt L R 1986 A statistical method for identifying transition states in high dimensional problems J. Chem. Phys. 85 5045-8... [Pg.2288]

Besides molecular orbitals, other molecular properties, such as electrostatic potentials or spin density, can be represented by isovalue surfaces. Normally, these scalar properties are mapped onto different surfaces see above). This type of high-dimensional visualization permits fast and easy identification of the relevant molecular regions. [Pg.135]

Previous work in our group had shown the power of self-organizing neural networks for the projection of high-dimensional datasets into two dimensions while preserving clusters present in the high-dimensional space even after projection [27]. In effect, 2D maps of the high-dimensional data are obtained that can show clusters of similar objects. [Pg.193]

SONNIA can be employed for the classification and clustering of objects, the projection of data from high-dimensional spaces into two-dimensional planes, the perception of similarities, the modeling and prediction of complex relationships, and the subsequent visualization of the underlying data such as chemical structures or reactions which greatly facilitates the investigation of chemical data. [Pg.461]

One technique for high dimensional data is to reduce the number of dimensions being plotted. For example, one slice of a three-dimensional data set can be plotted with a two-dimensional technique. Another example is plotting the magnitude of vectors rather than the vectors themselves. [Pg.118]

Nylon-12,12. Nylon-12,12 [36497-34-4] [36348-71-7] was introduced into the marketplace by Du Pont in the late 1980s (174). This polymer possesses very low moisture absorption, high dimensional stabihty, and excellent chemical resistance, with a moderately high melt point (T = 185° C)... [Pg.236]

A recently introduced polycarbonate-based blend offers a low coefficient of thermal expansion. This new thermoplastic is designed for large sheet applications such as doors or siding. Its high dimensional stability will eliminate warping from exposure to varying temperatures. [Pg.334]

Calcium Silicate Brick. Sand—lime brick is used ia masonry ia the same way as common clay brick. The bricks, molded from a wet mixture of sand and high calcium hydrated lime, are heated under pressure ia a steam atmosphere. Complex hydrosiUcates are formed that give the bricks high dimensional stabiUty (6). [Pg.408]

As stated earlier, the main motivation for using either PCA or PCA is to construct a low-dimensional representation of the original high-dimensional data. The notion behind this approach is that the effective (or essential, as some call it [33]) dimensionality of a molecular conformational space is significantly smaller than its full dimensionality (3N-6 degrees of freedom for an A-atom molecule). Following the PCA procedure, each new... [Pg.87]

The finished mouldings have high dimensional stability, low water absorption and good resistance to tracking. They also exhibit good heat resistance and mouldings cU e said to have withstood temperatures of 200 C without undue deterioration. [Pg.775]

Important properties of epoxy resins include their ability to adhere strongly to metal surfaces, their resistance to chemicals, and their high dimensional stability. They can also withstand temperatures up to 500°C. [Pg.345]

Fluorocarbons Very high heat and chemical resistance, nonburning, lowest coefficient of friction, high dimensional stability Injection molding Encapsulation Continuous pultrusion... [Pg.558]

If high impact resistance is required, the PA can be modified with rubber particles.11,15 The blends are usually made by reactive compounding from maleic-anhydride-modified rubbers, such as, EPDM, EPR, polybutadiene, or SEBS. Partial amorphous PA with a high Tg combines to give a high dimensional stability and good solvent resistance with transparency. [Pg.149]

Y. Mallet, D. Coomans and O. de Vel, Recent developments in discriminant analysis on high dimensional spectral data. Chemom. Intell. Lab. Systems, 35 (1996) 157-173. [Pg.240]


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See also in sourсe #XX -- [ Pg.664 ]




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Absorption Columns or High Dimensional Lumped, Steady State and Equilibrium Stages Systems

CLASSIFICATION SUPERVISED LEARNING WITH HIGH-DIMENSIONAL BIOLOGICAL DATA

Comparison of Classification Methods Using High-Dimensional Data

High three-dimensional view

High-Dimensional Biological Data

High-Dimensional Models

High-Resolution Two-Dimensional Electrophoretic Techniques

High-Speed Two-Dimensional Capillary Electrophoresis

High-dimensional biological data, statistical

High-dimensional data

High-dimensional linear maps

High-dimensional model representation

High-dimensional model representation HDMR)

High-dimensional neural network potential-energy surfaces

High-dimensional sequence space

High-resolution two-dimensional

Highly Conducting One-Dimensional Systems

One-Dimensional, High-Velocity Gas Flow

Phase diagram high-dimensional

Silicon polymers, high dimensional

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