292 citations · 341 across the 8 of their papers we have counts for
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cs.LG2024★ 2 cited
Stiefel Flow Matching for Moment-Constrained Structure Elucidation
Austin Cheng, Alston Lo, Kin Long Kelvin Lee +2
Molecular structure elucidation is a fundamental step in understanding chemical phenomena, with applications in identifying molecules in natural products, lab syntheses, forensic s…
q-bio.BM2024
Procedural Synthesis of Synthesizable Molecules
Michael Sun, Alston Lo, Minghao Guo +3
Designing synthetically accessible molecules and recommending analogs to unsynthesizable molecules are important problems for accelerating molecular discovery. We reconceptualize b…