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化学信息学

近期论文

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(1) L. Jin*, Y.L. Wu. Molecular Mechanism of δ-Dendrotoxin-Potassium Channel Recognition Explored by Docking and Molecular Dynamic Simulations.Journal of Molecular Recognition, 2011,24: 101-107 (2) L. Jin*, Y.L. Wu. Molecular Mechanism of the Sea Anemone Toxin ShK Recognizing the Kv1.3 Channel Explored by Docking and Molecular Dynamic Simulations. Journal of Chemical Information and Modeling, 2007, 47: 1967-1972 (3)L. Jin, Q.S. Xu, J. Smeyers-Verbeke, D.L. Massart. Updating multivariate calibrations with the Delaunay triangulation method: The creation of a new local model. Chemometrics and Intelligent Laboratory Systems, 2006, 80: 87-98. (4) L. Jin, Q.S. Xu, D.L. Massart. Multivariate calibrations with the Delaunay triangulation method: Definition of the calibration domain. Spectroscopy Letters, 2005, 38 : 787-807. (5) L. Jin, Q.S. Xu, J. Smeyers-Verbeke, D.L. Massart. Updating multivariate calibrations with the Delaunay triangulation method. Applied Spectroscopy, 2005, 59: 1125-1135

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