1 citations · 1 across the 3 of their papers we have counts for
3 papers
physics.comp-ph2025
Committors without Descriptors
Peilin Kang, Jintu Zhang, Enrico Trizio +2
The study of rare events is one of the major challenges in atomistic simulations, and several enhanced sampling methods towards its solution have been proposed. Recently, it has be…
physics.comp-ph2024
Combining transition path sampling with data-driven collective variables through a reactivity-biased shooting algorithm
Jintu Zhang, Odin Zhang, Luigi Bonati +1
Rare event sampling is a central problem in modern computational chemistry research. Among the existing methods, transition path sampling (TPS) can generate unbiased representation…
q-bio.BM2023★ 1 cited
Infinite Physical Monkey: Do Deep Learning Methods Really Perform Better in Conformation Generation?
Haotian Zhang, Jintu Zhang, Huifeng Zhao +2
Conformation Generation is a fundamental problem in drug discovery and cheminformatics. And organic molecule conformation generation, particularly in vacuum and protein pocket envi…