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HWAHAK KONGHAK,
Vol.31, No.6, 647-657, 1993
Vol.31, No.6, 647-657, 1993
Group Contribution Method의 작용기 분석을 위한 전문가 시스템 개발
Development of an Expert Systme for Functional Group Analysis in Group Contribution Method
주어진 분자식으로부터 작용기의 조합을 얻어내는 컴퓨터 프로그램을 개발하였다. 이 프로그램은 rule-based전문가 시스템의 형태를 가지고 있으며, common LISP를 사용하였다. 추론기관은 전방향 추론을 채택하여 직접 개발하였고, 지식베이스는 meta rule 80개, select rule 34개 및 combine rule 7개로 구성되었다. Joback Group Contribution Method에 따라서 작용기를 설정하였으며, 8개 이하의 그룹으로 구성된 화합물들에 대하여 오류값이 작용기의 조합을 구할 수 있었다.
A computer program which gave a functional group set from a given chemical formular was developed. this program has the form of a fule-based expert system, using the common LISP. The inference engine was developed using the forward chaining technique, and the knowledge base was composed of 80meta rules, 34 select rules and 7 combine rules. The functional groups were chosen following the Joback group contribution method, and the functional group sets were successfully obtained for the substances of less than 8 groups.
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[Cited By]
참고문헌정보(참고문헌, 인용문헌)는 화학공학소재연구정보센터에 의해 제공되고 있습니다.