STUDY OF BUILDING 3—D MOLECULAR STRUCTURE OF MACRORINGS

STUDY OF BUILDING 3—D MOLECULAR STRUCTURE OF MACRORINGS

The method of automatically building 3-D molecular structure ofmacrorings is proposed in the paper.The method can build the 3-D models ofmacrorings full automatically with the support of a knowledge base.The restrictionsof templet methods of building rings have been overcome.The results can meet the...

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Veröffentlicht in:东南大学学报：英文版 1993 (1), p.54-59
1. Verfasser: 艾竹茗 韦钰
Format: Artikel
Sprache:eng
Schlagworte:
design
distance
geometry
molecular
structure
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Zusammenfassung:The method of automatically building 3-D molecular structure ofmacrorings is proposed in the paper.The method can build the 3-D models ofmacrorings full automatically with the support of a knowledge base.The restrictionsof templet methods of building rings have been overcome.The results can meet theneeds of computer-aided molecular design.The distance geometry and its error func-tions in the method have been discussed in detail.
ISSN:1003-7985