Representation of Intermolecular Potential Functions by Neural Networks
β Scribed by Gassner, Helmut; Probst, Michael; Lauenstein, Albert; Hermansson, Kersti
- Book ID
- 126445550
- Publisher
- American Chemical Society
- Year
- 1998
- Tongue
- English
- Weight
- 138 KB
- Volume
- 102
- Category
- Article
- ISSN
- 1089-5639
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π SIMILAR VOLUMES
A nex simple function which is capable of representing the intermolecular pair potential energy of tic kert gases is proposed. It is based on the traditional n-6 rcciprocaf power poten..iaI with the modification that n is regarded iis a function of separation rather than as a constant.
We give upper bounds on rates of approximation of real-valued functions of d Boolean variables by one-hidden-layer perceptron networks. Our bounds are of the form c/ n p where c depends on certain norms of the function being approximated and n is the number of hidden units. We describe sets of funct