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Jun-Han You

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#software testing Open access Sep 2026

Biological Pauli Holes: analysis code and numerical results

Analysis code and numerical results for a study of whether Pauli confinement of a transferring hydrogen can contribute to enzyme catalysis, tested in soybean lipoxygenase. Contains the analysis code (the confined-hydrogen solver, the SAPT exchange-curvature campaigns, the range-weight budget, the transverse proton Hess...

Liang Feng Dong, Jun-Han You · 0 citations
#software testing Open access Sep 2026

Biological Pauli Holes: analysis code and numerical results

Analysis code and numerical results for a study of whether Pauli confinement of a transferring hydrogen can contribute to enzyme catalysis, tested in soybean lipoxygenase. Contains the analysis code (the confined-hydrogen solver, the SAPT exchange-curvature campaigns, the range-weight budget, the transverse proton Hess...

Liang Feng Dong, Jun-Han You · 0 citations

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