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2002 • 3,432 citations

Neural network architectures: an introduction

1991 • 670 citations

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1997 • 555 citations

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1999 • 75 citations

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2002 • 51 citations

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1997 • 48 citations

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2000 • 40 citations

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1999 • 31 citations

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2001 • 14 citations

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1999 • 8 citations