Barely Significant
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Unphysical Structure Collapse in Quantum Mechanics Calculations With Continuum Solvation.

Chemphyschem · 2026 · PMC12963697 · PMID 41787743

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quite significantno p-value reported
After optimization, for water solvation we find 65 conformers with ring–ring distances below and 83 with distances beyond 5 Å, and for CHCl 3 we find 29 and 68, respectively, i.e., a quite significant shift toward collapsed conformers.

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