Bai Xue

3PUBLICATIONS
19CO-AUTHORS
Atomic and molecular physicsComputational chemistry
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Publications (3)

|Apr 13, 2026
TripKa: Accurate and Scalable Acid-Base Dissociation Property Prediction via Triplet Interaction Networks and Physical Knowledge.

Wentao Wei, Jiahua Rao, Bai Xue

|Dec 29, 2023
Development and Comprehensive Benchmark of a High-Quality AMBER-Consistent Small Molecule Force Field with Broad Chemical Space Coverage for Molecular Modeling and Free Energy Calculation.

Bai Xue, Qingyi Yang, Qiaochu Zhang

|Nov 26, 2022
Collaborative Assessment of Molecular Geometries and Energies from the Open Force Field.

Lorenzo D'Amore, David F Hahn, David L Dotson

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Frequent Collaborators

2 joint publications

Mingjun Yang

1 joint publications

Lorenzo D'Amore

1 joint publications

Jamshed Anwar

1 joint publications

Thomas Fox