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20242026
most citedBridging Quantum Mechanics to Liquid Properties via a Universal Organic Force Field

3 citations · 3 across the 5 of their papers we have counts for

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physics.chem-ph2026

THEMol dataset: Torsion, Hessian, and Energy of Molecules

Jiashu Liang, Tianze Zheng, Yu Xia +13

We present THEMol (Torsion, Hessian, Energy of Molecules), a massive open-source collection of quantum mechanical properties tailored for closed-shell organic molecules, with up to…