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jcisd 2000
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Fast Similarity Search in Three-Dimensional Structure Databases
13 years 6 months ago
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faculty.fullerton.edu
Xiong Wang, Jason Tsong-Li Wang
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Quasi-orthogonal Basis Sets of Molecular Graph Descriptors as a Chemical Diversity Measure
13 years 6 months ago
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Ovidiu Ivanciuc, Stavros L. Taraviras, Daniel Cabr...
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Combinatorial Library Design: Maximizing Model-Fitting Compounds within Matrix Synthesis Constraints
13 years 6 months ago
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Robert V. Stanton, John Mount, Jennifer L. Miller
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Symbolic, Neural, and Bayesian Machine Learning Models for Predicting Carcinogenicity of Chemical Compounds
13 years 6 months ago
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Dennis Bahler, Brian Stone, Carol Wellington, Doug...
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Pentaheptite Modifications of the Graphite Sheet
13 years 6 months ago
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Michel Deza, Patrick W. Fowler, Mikhail Shtogrin, ...
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