| Forces are not enough: Benchmark and critical evaluation for machine learning force fields with molecular simulations X Fu, Z Wu, W Wang, T Xie, S Keten, R Gomez-Bombarelli, T Jaakkola Transactions on Machine Learning Research (TMLR), 2022 | 214 | 2022 |
| Sequence-engineering polyethylene–polypropylene copolymers with high thermal conductivity using a molecular-dynamics-based genetic algorithm T Zhou, Z Wu, HK Chilukoti, F Müller-Plathe Journal of Chemical Theory and Computation 17 (6), 3772-3782, 2021 | 40 | 2021 |
| Learning pair potentials using differentiable simulations W Wang, Z Wu, JCB Dietschreit, R Gómez-Bombarelli The Journal of Chemical Physics 158 (4), 2023 | 30 | 2023 |
| Boron-modified perhydropolysilazane towards facile synthesis of amorphous SiBN ceramic with excellent thermal stability Y Zhan, W Li, T Jiang, C Fasel, E Ricohermoso III, J Bernauer, Z Yu, Z Wu, ... Journal of Advanced Ceramics 11 (7), 1104-1116, 2022 | 28 | 2022 |
| Combination of hybrid particle-field molecular dynamics and slip-springs for the efficient simulation of coarse-grained polymer models: Static and dynamic properties of … Z Wu, G Milano, F Müller-Plathe Journal of Chemical Theory and Computation 17 (1), 474-487, 2021 | 28 | 2021 |
| Helically intersected conductive network design for wearable electronic devices: from theory to application Y Li, K Zhang, Q Geng, M Nie, Q Wang, Z Huang, Z Wu, L Pi ACS Applied Materials & Interfaces 13 (9), 11480-11488, 2021 | 15 | 2021 |
| Atomistic hybrid particle‐field molecular dynamics combined with slip‐springs: Restoring entangled dynamics to simulations of polymer melts Z Wu, A Kalogirou, A De Nicola, G Milano, F Müller‐Plathe Journal of Computational Chemistry 42 (1), 6-18, 2021 | 15 | 2021 |
| Compatibilization efficiency of graft copolymers in incompatible polymer blends: Dissipative particle dynamics simulations combined with machine learning T Zhou, D Qiu, Z Wu, SAN Alberti, S Bag, J Schneider, J Meyer, JA Gámez, ... Macromolecules 55 (17), 7893-7907, 2022 | 14 | 2022 |
| Knotting behaviour of polymer chains in the melt state for soft-core models with and without slip-springs Z Wu, SAN Alberti, J Schneider, F Müller-Plathe Journal of Physics: Condensed Matter 33 (24), 244001, 2021 | 12 | 2021 |
| Implicit chain particle model for polymer-grafted nanoparticles Z Wu, S Pal, S Keten Macromolecules 56 (9), 3259-3271, 2023 | 11 | 2023 |
| Compatibilization efficiency of additives in homopolymer blends: a dissipative particle dynamics study T Zhou, J Schneider, Z Wu, F Müller-Plathe Macromolecules 54 (20), 9551-9564, 2021 | 11 | 2021 |
| How ethanolic disinfectants disintegrate coronavirus model membranes: A dissipative particle dynamics simulation study T Zhou, Z Wu, S Das, H Eslami, F Müller-Plathe Journal of Chemical Theory and Computation 18 (4), 2597-2615, 2022 | 9 | 2022 |
| The role of the envelope protein in the stability of a coronavirus model membrane against an ethanolic disinfectant S Das, MK Meinel, Z Wu, F Müller-Plathe The Journal of Chemical Physics 154 (24), 2021 | 9 | 2021 |
| Slip-spring hybrid particle-field molecular dynamics for coarse-graining branched polymer melts: Polystyrene melts as an example Z Wu, F Müller-Plathe Journal of Chemical Theory and Computation 18 (6), 3814-3828, 2022 | 7 | 2022 |
| Structural Coarse-Graining via Multiobjective Optimization with Differentiable Simulation Z Wu, T Zhou Journal of Chemical Theory and Computation 20 (6), 2605–2617, 2024 | 6 | 2024 |
| Effect of Defects on the Interfacial Thermal Conductance between n-Heneicosane in Solid and Liquid Phases and a Graphene Monolayer T Zhou, HK Chilukoti, Z Wu, F Müller-Plathe The Journal of Physical Chemistry C 125 (25), 14149-14162, 2021 | 6 | 2021 |
| Characterizing the shear response of polymer-grafted nanoparticles A Moussavi, S Pal, Z Wu, S Keten The Journal of Chemical Physics 160 (13), 2024 | 4 | 2024 |
| Understanding the Interfacial and Self-Assembly Behavior of Multiblock Copolymers for Developing Compatibilizers toward Mechanical Recycling of Polymer Blends T Zhou, X Ning, Z Wu, X Lan, C Xu Industrial & Engineering Chemistry Research 63 (15), 6766-6773, 2024 | 3 | 2024 |
| 人工智能驱动化学品创新设计的实践与展望 吴正浩， 周天航， 蓝兴英， 徐春明 化工进展 42 (8), 3910-3916, 2023 | 3* | 2023 |
| Tuning the interfacial reaction environment via pH-dependent and induced ions to understand C–N bonds coupling performance in NO3− integrated CO2 reduction to carbon and … T Zhou, C Shen, Z Wu, X Lan, Y Xiao Journal of Energy Chemistry 100, 273-285, 2025 | 2 | 2025 |
Tianhang ZhouAssistant Professor, China University of Petroleum (Beijing), Dr. rer. nat. with distiction.theo.chemie.tu-darmstadt.de üzerinde doğrulanmış e-posta adresine sahip
