Numerical computing, intelligent

Intelligence in Numerical Computing improving Batch Scheduling Algorithms through Explanation-Based Learning... [Pg.10]

The main goal of this chapter is to introduce the concept of intelligent numerical computing within the context of solving optimization problems... [Pg.271]

Most of the applications of artificial intelligence in chemistry so far have not involved numerical computation as a primary goal. Yet there are aspects of the AI approach to problem-solving which have relevance to computation. In scientific computation, one could view the knowledge base as the set of equations, input variable values, and unit conversions relevant to the problem, and the inference engine the numerical method used to solve the equations. This paper describes such a software system,... [Pg.111]

KARMA is an interactive computer assisted drug design tool that incorporates quantitative structure-activity relationships (QSAR), conformational analysis, and three-dimensional graphics. It represents a novel approach to receptor mapping analysis when the x-ray structure of the receptor site is not known, karma utilizes real time interactive three-dimensional color computer graphics combined with numerical computations and symbolic manipulation techniques from the field of artificial intelligence. [Pg.147]

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