Zhonglin Cao

China National Petroleum Corporation (China) — China

Engineering · Physical Sciences

21h-index2.4kcitations55works19.12yr avg
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Research Topics

Nanopore and Nanochannel Transport Studies(13), Membrane Separation Technologies(11), Graphene research and applications(7), Computational Drug Discovery Methods(7), Machine Learning in Materials Science(7)

Publications55 total

Efficient Molecular Conformer Generation with SO(3)-Averaged Flow Matching and Reflow
arXiv (Cornell University)·2025Open Access
Up/down and P/S decomposition of distributed acoustic sensing vertical seismic profiling data using multitask deep-learning method
Geophysics·2025
Elastic wavefield separation of DAS-VSP data based on nonstationary polarization projection
Geophysics·2025· 2 cited
EquiJump: Protein Dynamics Simulation via SO(3)-Equivariant Stochastic Interpolants
arXiv (Cornell University)·2024Open Access
PLINDER: The protein-ligand interactions dataset and evaluation resource
2024· 52 citedOpen Access
Recent progress in stimuli-responsive polymeric micelles for targeted delivery of functional nanoparticles
Advances in Colloid and Interface Science·2024· 45 cited
Fast Water Desalination with a Graphene–MoS<sub>2</sub> Nanoporous Heterostructure
ACS Applied Materials & Interfaces·2024· 13 citedOpen Access
Large-Scale Pretraining Improves Sample Efficiency of Active Learning-Based Virtual Screening
Journal of Chemical Information and Modeling·2024· 16 cited
Machine Learning in Membrane Design: From Property Prediction to AI-Guided Optimization
Nano Letters·2024· 55 citedOpen Access
Recent Advances in Self-healing Polymer Materials: Routes and Strategies
Current Organic Chemistry·2024· 8 cited
ROCS datasets for "Large-scale Pretraining Improves Sample Efficiency of Active Learning Based Virtual Screening"
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
ROCS datasets for "Large-scale Pretraining Improves Sample Efficiency of Active Learning Based Virtual Screening"
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Large-scale Pretraining Improves Sample Efficiency of Active Learning based Molecule Virtual Screening
arXiv (Cornell University)·2023Open Access
Neural network predicts ion concentration profiles under nanoconfinement
The Journal of Chemical Physics·2023· 2 cited
Bio-Based Self-Healing Polymeric Materials Derived from Furfuryl Alcohol Based on the Diels-Alder Reversible Reaction
Polymer Science Series B·2023· 6 cited
DNA Detection Using a Single-Layer Phosphorene Nanopore
ACS Applied Nano Materials·2023· 10 citedOpen Access
Neural Network Predicts Ion Concentration Profiles under Nanoconfinement
arXiv (Cornell University)·2023Open Access
MOFormer: Self-Supervised Transformer Model for Metal–Organic Framework Property Prediction
Journal of the American Chemical Society·2023· 141 citedOpen Access
MOFormer: Self-Supervised Transformer model for Metal-Organic Framework Property Prediction
arXiv (Cornell University)·2022· 2 citedOpen Access
Which 2D Material is Better for DNA Detection: Graphene, MoS<sub>2</sub>, or MXene?
Nano Letters·2022· 31 cited
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Frequent Co-authors

Amir Barati Farimani(22), Yuyang Wang(10), Prakarsh Yadav(5), Guangzhao Zhang(4), Simone Sciabola(4), Ye Wang(4), Vincent Liu(3), Gaixia Xu(3), Ken‐Tye Yong(3), Emine Küçükbenli(3), Jianren Wang(2), Zhong Ma(2), Lijia Pan(2), Rishikesh Magar(2), Hu Hui(2), Xiaodong Fan(2), Xiaomei Wang(2), Omid Barati Farimani(2), Xiaoling Zuo(2), Parisa Mollaei(2)