Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Applying a transform

IS EACH REACTION FEASIBLE GIVEN THE ATOMS, FUNCTIONAL GROUPS, RINGS, ETC. LOCAL TO THE REACTION SITES  [Pg.90]

GLOBAL REACTIONS RAW MATERIAL COSTS MECHANISM THERMOCHEMISTRY BYPRODUCTS, ETC. [Pg.90]

CONTINUE WITH PRECURSORS AND SUBGOALS UNTIL AVAILABLE RAW MATERIALS ARE ENCOUNTERED [Pg.90]

ACS Symposium Series American Chemical Society Washington, DC, 1977. [Pg.90]

Corey and co-workers (5) have developed a library of over 300 transforms of this type. Most of the secondary checks on the reactions (i.e. the affect of local attachments) are knowledgeable generalizations of the reviews published by Marsh (, House (7), and Buehler and Pearson (.  [Pg.91]


The target compound is searched for a rctron. A retron is the structural subunit required to be present in the target in order to apply a transform. In Figure 10,3-30 the rctron of a Michael addition is a sequence of five carbon atoms with two carbonyl functions in the 1,5-position. For a Michael addition transform to be applied, it has to be present,... [Pg.570]

Correspondence factor analysis can be described in three steps. First, one applies a transformation to the data which involves one of the three types of closure that have been described in the previous section. This step also defines two vectors of weight coefficients, one for each of the two dual spaces. The second step comprises a generalization of the usual singular value decomposition (SVD) or eigenvalue decomposition (EVD) to the case of weighted metrics. In the third and last step, one constructs a biplot for the geometrical representation of the rows and columns in a low-dimensional space of latent vectors. [Pg.183]

For large molecules, the equivalent-orbital analysis is the most convenient starting point for a molecular-orbital treatment. In a molecule such as a long-chain paraffin it is possible to write approximate equivalent orbitals corresponding to each bond and then to apply a transformation to obtain the delocalised molecular orbitals. Simple assumption about, the interaction of neighbouring bonds will then lead to estimates of the relative stability of the various energy levels.9... [Pg.195]

Apply a transformation to the data to make the transformed data normal. If the distribution is skewed to the right, one might try a log, inverse, square root, or cube root transformation of the data to make the data normal. If the data are skewed to the left, an exponential, squared, or cubed transformation might be applied. A histogram can be applied before and after the transformation to assess the ability of the transformation to make the data normal. It is important to remember that the transformation must be applied to the USL and LSL, in addition to the data, before computing the capability index of interest. [Pg.3507]

Note that by this method values of b take positive signs since, in effect, the signs of To and Tp (see below of. and Jp of the previous method) have been reversed. This is done to make the working easier and is allowed for subsequently. Check the several values of b for parallelism by the rule given above, and apply a transformation if necessary. [Pg.234]

While the next step for the FW transformation was a renormalization by means of the transformation Wb in order to achieve an overall unitary transformation (which can actually be done before or after the projection to positive energy states), we now apply a transformation that simultaneously block-diagonalizes the Hamiltonian for electrons, such that it isolates a block corresponding to the model space, reestablishes unitarity of this... [Pg.721]

Figure 7. Steps in applying a transform based on the substructures which mange during reaction... Figure 7. Steps in applying a transform based on the substructures which mange during reaction...
The multigroup calculational method based on the Goertzel-Selengut model has also been tested in the calculation of critical assemblies. E. G. Silver has compared the computed critical masses from the Eye Wash code with the experimentally determined values for the case of enriched uranium assemblies in water. Unfortunately the evaluation of the analytical model was not clear cut since it was necessary to apply a transformation from the actual completely reflected parallelepiped geometry to a three-region spherical model. Some aspects of this problem were discussed previously in Sec. 8.6. These considerations are discussed in... [Pg.761]

The Hamiltonian has been used by Almlof et al. (1985), and also by Buenker et al. (1984). As we showed in the perturbation analysis above, the energies in this approximation are too low at 0(c ). To remedy this deficiency, we may apply a transformation derived by Douglas and Kroll (1974) to further reduce the magnitude... [Pg.305]

If applying a transformation derived from the decoupling of the unperturbed Dirac Hamiltonian was potentially unreliable for electric properties, for magnetic properties it simply will not work. The reason is that magnetic perturbations enter through the vector potential A and thus are odd operators. [Pg.317]

The usual procedure for applying a transformation O would be to insert d 0 between the wave function and the Hamiltonian and premultiply by O. Using (17.5) this procedure gives... [Pg.325]


See other pages where Applying a transform is mentioned: [Pg.311]    [Pg.57]    [Pg.423]    [Pg.224]    [Pg.11]    [Pg.160]    [Pg.90]    [Pg.118]    [Pg.428]    [Pg.644]    [Pg.113]    [Pg.121]    [Pg.103]   
See also in sourсe #XX -- [ Pg.90 , Pg.200 ]




SEARCH



© 2024 chempedia.info