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2. Xing, J.-Y.; Lu, Z.-Y.; Liu, H.*; Xue, Y.-H., The selectivity of nanoparticles for polydispersed ligand chains during the grafting-to process: a computer simulation study. Physical Chemistry Chemical Physics 2018, 20(3), 2066-2074.

3. Xu, D.; Ni, C.-Y.; Zhu, Y.-L.; Lu, Z.-Y.; Xue, Y.-H.; Liu, H.*, Kinetic step-growth polymerization: A dissipative particle dynamics simulation study. The Journal of Chemical Physics 2018, 148 (2), 024901.

4. Fan, J.-B.^#; Liu, H.^#; Song, Y.^#; Luo, Z.; Lu, Z.-Y.*; Wang, S.-T.*, Janus Particles Synthesis by Emulsion Interfacial Polymerization: Polystyrene as Seed or Beyond? Macromolecules 2018, 51(5), 1591-1597.

5. Zhang, L.-H.; Li, W.-C.; Liu, H.; Wang, Q.-G.; Tang, L.; Hu, Q.-T.; Xu, W.-J.; Qiao, W.-H.; Lu, Z.-Y.; Lu, A.-H.*, Thermoregulated Phase-Transition Synthesis of Two-Dimensional Carbon Nanoplates Rich in sp2 Carbon and Unimodal Ultramicropores for Kinetic Gas Separation. Angewandte Chemie International Edition, 2018, 57(6), 1632-1635.

6. Liu, H.; Zhao, H.-Y.; Müller-Plathe, F.; Qian, H.-J.; Sun, Z.-Y.; Lu, Z.-Y.*, Distribution of the Number of Polymer Chains Grafted on Nanoparticles Fabricated by Grafting-to and Grafting-from Procedures. Macromolecules 2018, 51 (10), 3758-3766.

7. Zhu, Y.-L.; Pan, D.; Li, Z.-W.; Liu, H.; Qian, H.-J.; Zhao, Y.; Lu, Z.-Y.*; Sun, Z.-Y., Employing multi-GPU power for molecular dynamics simulation: an extension of GALAMOST. Molecular Physics 2018, 116 (7-8), 1065-1077.

8. Li, L.; Han, C.; Xu, D.; Xing, J.-Y.; Xue, Y.-H.*; Liu, H., Polymer-grafted nanoparticles prepared via a grafting-from strategy: a computer simulation study. Physical Chemistry Chemical Physics 2018, 20(27), 18400-18409. 

9. Wang, D.; Yu, C.; Xu, L.; Shi, L.; Tong, G.; Wu, J.; Liu, H.; Yan, D.; Zhu, X.*, Nucleoside Analogue-Based Supramolecular Nanodrugs Driven by Molecular Recognition for Synergistic Cancer Therapy. Journal of the American Chemical Society 2018, 140 (28), 8797-8806.

10. Xu, J.; Xue, Y.-H.; Cui, F.-C.; Liu, H.*; Lu, Z.-Y.*, Simultaneous polymer chain growth with the coexistence of bulk and surface initiators: insight from computer simulations. Physical Chemistry Chemical Physics 2018, 20(35), 22576-22584.

11.  Kong, S.-M.; Liu, H.*, Xue, Y.-H.; Liu, X.-L.; Jia, X.-X.; Cui, F.-C.*, Polymerization-induced polymer aggregation or polymer aggregation-enhanced polymerization? a computer simulation study.  Physical Chemistry Chemical Physics 2018, 20(37), 24379-24388.