Method for planning the generation of combinatorial chemistry libraries method for planning the generation of combinatorial chemistry libraries
This invention relates to a system and method useful for the generation and representation of chemical libraries and, more particularly, to a computer-implemented system and method useful for the generation and representation of combinatorial chemistry libraries. A computer-implemented method and ap...
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| Format | Patent |
| Language | English |
| Published |
23.04.2002
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| Online Access | Get full text |
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| Summary: | This invention relates to a system and method useful for the generation and representation of chemical libraries and, more particularly, to a computer-implemented system and method useful for the generation and representation of combinatorial chemistry libraries.
A computer-implemented method and apparatus are provided for planning the generation of combinatorial chemical libraries produced by a series of chemical reaction stages, each stage involving a multiplicity of simultaneous chemical reactions utilizing a set of potential synthons. The disclosed method and apparatus involve enumerating the members of the proposed library and determining which of the members meet desired criteria. |
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