Principal component analysis combined with truncated-Newton minimization for dimensionality reduction of chemical databases
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Publication:1411638
DOI10.1007/S10107-002-0345-7zbMath1030.90514OpenAlexW2052054742MaRDI QIDQ1411638
Eugene M. Fluder, Dexuan Xie, Suresh B. Singh, Tamar Schlick
Publication date: 29 October 2003
Published in: Mathematical Programming. Series A. Series B (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1007/s10107-002-0345-7
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An incomplete Hessian Newton minimization method and its application in a chemical database problem ⋮ Convergence analysis of truncated incomplete Hessian Newton minimization method and application in biomolecular potential energy minimization
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