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Theoretical and Computational Chemistry

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E. Adrian Henle

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Theoretical and Computational Chemistry

PoreMatMod.jl: Julia package for in silico post-synthetic modification of crystal structure models

E. Adrian Henle, Nickolas Gantzler, Praveen K. Thallapally, Xiaoli Z. Fern, Cory M. Simon

274

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Theoretical and Computational Chemistry

Classifying the toxicity of pesticides to honey bees via support vector machines with random walk graph kernels

Ping Yang, E. Adrian Henle, Xiaoli Fern, Cory M. Simon

554

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