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Fragmentation structure generator

K kleinere jump to the first fragment structure generated by truncation of one atom/ring... [Pg.238]

In principle, two different classes of structure generators can be distinguished, namely empirical approaches,. such as fragment-based or rule- and data-based... [Pg.95]

H. J. Bohm, Site directed structure generation by fragment joining, Perspect. Drug Disc. [Pg.332]

Figure 5.12 Detection of components in the MFTA supergraph and the construction of a fragmental supergraph for structure generation. Figure 5.12 Detection of components in the MFTA supergraph and the construction of a fragmental supergraph for structure generation.

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See also in sourсe #XX -- [ Pg.280 ]




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