ALGORITHM SELECTING METHOD AND INFORMATION PROCESSING APPARATUS

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United States of America Patent

APP PUB NO 20240104263A1
SERIAL NO

18337474

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Abstract

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An information processing apparatus calculates a plurality of first molecular energies corresponding to a plurality of first interatomic distances by using a first algorithm that iteratively updates a solution until a convergence condition is satisfied. The information processing apparatus specifies, based on a slope of a line segment indicating a relationship between the plurality of first interatomic distances and iteration counts, a plurality of second interatomic distances for which molecular energy is to be calculated by using a second algorithm. The information processing apparatus calculates second molecular energies corresponding to the specified plurality of second interatomic distances by using the second algorithm.

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Patent Owner(s)

Patent OwnerAddress
FUJITSU LIMITED1-1 KAMIKODANAKA 4-CHOME NAKAHARA- KU KAWASAKI-SHI KANAGAWA 211-8588 211-8588

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Inventor(s)

Inventor Name Address # of filed Patents Total Citations
IMAMURA, Satoshi Kawasaki, JP 42 174

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