Publications

23. Gu Q. A., Li K., Li S. L., Cui R., Liu L. F., Yu C. Y., Wang Y. L., Zhou Y. F., Xiao G. Y. In silico study of structure and water dynamics in CNT/polyamide nanocomposite reverse osmosis membranes. Phys. Chem. Chem. Phys., 2020, 22, 22324-22331.

22. Li S. L., Yu C. Y. and Zhou Y. F. Computational design of Janus polymersomes with controllable fission from double emulsions. Phys. Chem. Chem. Phys., 2020, 22, 24934-24942.

21. Liu Y. N., Wang H., Li S. L., Chen C. S., Xu L., Huang P., Liu F., Su Y., Qi M. W., Yu C. Y. and Zhou Y. F. In situ supramolecular polymerization-enhanced self-assembly of polymer vesicles for highly efficient photothermal therapy. Nat. Commun., 2020, 11, 1724.

20. Li S. L., Xu Q. S., Li K., Yu C. Y. and Zhou Y. F. High-χ alternating copolymers for accessing sub-5 nm domains via simulations. Phys. Chem. Chem. Phys., 2020, 22, 5577-5583.

19. Li S. L., Xu Q. S., Li K., Wang Y. L., Yu C. Y. and Zhou Y. F. Multigeometry nanoparticles from the orthogonal self-assembly of block alternating copolymers via simulation. J. Phys. Chem. B, 2019, 123, 8333–8340.

18. Li S. L., Li K., Xu Q. S., Wang Y. L., Yu C. Y. and Zhou Y. F. Solution self-assembly behavior of rod-alt-coil alternating copolymer via simulations. Phys. Chem. Chem. Phys., 2019, 21, 25148–25157.

17. Li K., Li S. L., Liu L. F., Huang W., Wang Y. L., Yu C. Y. and Zhou Y. F. Molecular dynamics simulation studies of the structure and antifouling performance of a gradient polyamide membrane. Phys. Chem. Chem. Phys., 2019, 21, 19995-20002.

16. Li K., Li S. L., Huang W., Yu C. Y. and Zhou Y. F. MembrFactory: A force field and composition double independent universal tool for constructing polyamide reverse osmosis membranes. J. Comput. Chem., 2019, 40, 2432-2438.

15. Li S. L., Yu C. Y. and Zhou Y. F. Phase diagrams, mechanisms and unique characteristics of alternating-structured polymer self-assembly via simulations. Sci. China-Chem., 2019, 62, 226-237.

14. Tan H. N., Li S. L., Li K., Yu C. Y., Lu Z. Y. and Zhou Y. F. Shape transformations of vesicles self-assembled from amphiphilic hyperbranched multiarm copolymers via simulation. Langmuir, 2019, 35, 6929-6938.

13. Li K., Liu L. F., Wu H., Li S. L., Yu C. Y., Zhou Y. F. and Yan D. Y. Understanding of the temperature effect on thetransport dynamics and structures in polyamide reverse osmosis system via molecular dynamics simulations. Phys. Chem. Chem. Phys., 2018, 20, 29996-30005.

12. Li S. L., Zhang Y. L., Liu H., Yu C. Y., Zhou Y. F. and Yan D. Y. Asymmetric polymersomes from an oil-in-oil emulsion: A computer simulation study. Langmuir, 2017, 33, 10084-10093.

11. Yu C. Y., Ma L., Huang W., Zhou Y. F., Qin J. G. and Yan D. Y. Computer simulation studies of the influence of side alkyl chain on glass transition behavior of carbazole trimer. Sci. China. Chem., 2017, 60, 377-384.

10. Tan H. N., Yu C. Y., Lu Z. Y., Zhou Y. F. and Yan D. Y. A dissipative particle dynamics simulation study on phasediagrams for the self-assembly of amphiphilic hyperbranched multiarm copolymers in various solvents. Soft Matter,2017, 13, 6178-6188.

9. Yu C. Y., Ma L., Li K., Li S. L., Liu Y. N., Liu L. F., Zhou Y. F. and Yan D. Y. Computer simulation studies on the pH-responsive self-assembly of amphiphilic carboxy-terminated polyester dendrimers in aqueous solution. Langmuir, 2017, 33, 388-399.

8. Yu C. Y., Ma L., Li K., Li S. L., Liu Y. N., Zhou Y. F., and Yan D. Y. Molecular dynamics simulation studies of hyperbr-anched polyglycerols and their encapsulation behaviors of small drug molecules. Phys. Chem. Chem. Phys., 2016, 18, 22446-22457.

7. Yu C. Y., Ma L., Li S. L., Tan H. N., Zhou Y. F. and Yan D. Y. HBP Builder: A tool to generate hyperbranched polymers and hyperbranched multiarm copolymers for coarse-grained and fully atomistic molecular simulations. Sci. Rep., 2016, 6, 26264.

6. Huang L., Yu C.Y., Huang T., Xu S. T., Bai Y. P. and Zhou Y. F. Ultrasound-responsive ultrathin multiblock copoly-amide vesicles. Nanoscale, 2016, 8, 4922-4926.

5. Tan H. N., Wang W., Yu C. Y., Zhou Y. F., Lu Z. Y. and Yan D. Y. Dissipative particle dynamics simulation study on self-assembly of amphiphilic hyperbranched multiarm copolymers with different degrees of branching. Soft Matter, 2015, 11, 8460-8470.

4. Chen J. X., Yu C. Y., Shi Z. Q., Yu S. R., Lu Z. Y., Jiang W. F., Zhang M., He W., Zhou Y. F. and Yan D. Y. Ultrathin alternating copolymer nanotubes with readily tunable surface functionalities. Angew. Chem. Int. Ed., 2015, 54, 3621- 3625.

3. Wang Y. L., Li B., Jin H. B., Zhou Y. F., Lu Z. Y. and Yan D. Y. Dissipative particle dynamics simulation study on vesicles self‐assembled from amphiphilic hyperbranched multiarm copolymers. Chem. Asian J., 2014, 9, 2281-2288.

2. Wang Y. L., Li B., Zhou Y. F., Lu Z. Y. and Yan D.Y. Dissipative particle dynamics simulation study on the mechanisms of self-assembly of large multimolecular micelles from amphiphilic dendritic multiarm copolymers. Soft Matter, 2013, 9, 3293-3304.

1. Liu Y., Yu C. Y., Jin H. B., Jiang B. B., Zhu X. Y., Zhou Y. F., Lu Z. Y. and Yan D. Y. A supramolecular janus hyperbran-ched polymer and its photoresponsive self-assembly of vesicles with narrow size distribution. J. Am. Chem. Soc., 2013, 135, 4765-4770.