教學工作
主講:本科生課程《高分子鏈構象統計理論》;研究生課程《高分子凝聚態物理》
研究方向
1. 高分子凝聚態物理理論計算與模擬
2. 生物信息學
研究興趣
採用理論計算和模擬方法研究如下問題
1. 蛋白質與蛋白質、DNA、合成大分子及有機分子間相互作用
2. 多肽、合成大分子及有機小分子藥物設計
3. 雜鏈大分子及蛋白質單鏈摺疊和設計
4. 大分子粗粒化模型建立及多尺度模擬
5. 雜鏈大分子及蛋白質在熔體、溶液狀態下組裝及聚集
目前採用的手段包括:MC, MD, DPD, SCFT, DDFT等方法。
承擔項目
1.雜鏈大分子摺疊、設計和自組裝機理的研究: 國家傑出青年基金
2.聚烯烴的多重結構及其高性能化的基礎研究: 973國家重點基礎研究發展計畫
3.聚合物微觀、介觀和巨觀性質的理論與模擬: 國家自然科學基金重大項目子課題
4.溶劑揮發誘導下的自組裝行為: 理論物理學及交叉科學重大研究計畫面上項目
5.梳形嵌段聚合物組裝行為: 高等學校博士點專項基金
發表論文
1、Li, X. J.; Kou, D. Z.; Rao, S. L.; Liang, H. J. Developing a coarse-grained force field for the diblock copolymer poly(styrene-b-butadiene) from atomistic simulation. J. Chem. Phys. 2006, 124, 204909
2.Chen, P.; He, X. H.; Liang, H. J. Effect of surface field on the morphology of a symmetric diblock copolymer under cylindrical confinement. J. Chem. Phys. 2006, 124, 104906.
3.Chen, P.; Liang, H. J. Monte Carlo simulations of cylinder-forming ABC triblock terpolymer thin films. J. Phys. Chem. B 2006, 110, 18212.
4.Kou, D. Z.; Liang, H. J. Microstructures from a Mixture of ABC 3-Miktoarm Star Terpolymers and Homopolymers. J. Phys. Chem. B 2006, 110, 23557.
5.Huang, R.; Jiang, Y.; Liang, H. J. Effect of architecture on the tensile properties of triblock copolymers in a lamellar phase. ChemPhysChem 2006, 7, 1950.
6、Li, X.; Jiang, Y.; Li, Y. C.; Liang, H. J. Influence of electric field on the phase transitions of the hexagonal cylinder phase of diblock copolymers. ChemPhysChem 2006, 7, 1693
7.Huang, L.; Ma, X. J.; Liang, H. J. What is the origin of those common structures of protein-model chains? Polymer 2006, 47, 1755
8.Jiang Y, Huang R.; Liang HJ Effect of polydispersity on the tensile modulus of diblock copolymers in a lamellar phase J. Chem. Phys. 2005, 123, 124906
9.Jiang Y, Zhu JT, Jiang W & Liang HJ Cornucopian cylindrical aggregate morphologies from self-assembly of amphiphilic triblock copolymer in selective media J. Phys. Chem. B 2005, 109, 21549
10.Zhu JT, Jiang Y, Liang HJ & Jiang W Self-assembly of ABA amphiphilic triblock copolymers into vesicles in dilute solution J. Phys. Chem. B. 2005, 109, 8619
11.Jiang Y, Yan XY, Liang HJ & Shi AC Effect of polydispersity on the phase diagrams of linear ABC triblock copolymers in two dimensions J. Phys. Chem. B 2005, 109, 21047
12.Jiang Y, Liang HJ & Shi AC Effect of polydispersity on the formation of vesicles from amphiphilic diblock copolymers Macromolecules 2005, 38, 6710
13、Li XJ, Huang L & Liang HJ Developing coarse-grained force fields for cis-poly(1,4-butadiene) from the atomistic simulation Polymer 2005, 46, 6507
14.Sun DC, Huang L & Liang HJ Unstable inverted phases of di- and tri-block copolymers on solution-casting films Macromolecules Research 2005, 13, 152
15、Lu T, He XH & Liang HJ Ordered Microstructures by assembly of ABC 3-miktoarm star terpolymers and linear hompolymers J. Chem. Phys. 2004, 121, 9702
16.Xu BS, Huang L & Liang HJ Thermodynamic behaviors of polyampholytes at low temperatures J. Chem. Phys. 2004, 121, 7494
17.He XH, Liang HJ, Huang L & Pan CY Complex microstructures of amiphiphilic diblock copolymer in dilute solution J. Phys. Chem. B 2004, 108, 1731
18.Dai B, Song M, Hourston DJ, He XH, Liang HJ & Pan CY Influence of block lengths and symmetries of block copolymers on phase behavior of polymer A/polymer B/block copolymer ternary blends Polymer, 2004, 45 1019
19. Huang L, He XH, He TB & Liang HJ A cunning strategy in design of polymeric nanomaterials with novel microstructures J. Chem. Phys. 2003, 119, 12479
20. Huang L, Xe XH, Wang YY, Chen HN & Liang HJ Phase transition of short chains at ultra low temperature J. Chem. Phys. 2003, 119, 2432
21. He XH, Huang L, Liang HJ & Pan CY Localizations of junction points of ABC 3-miktoarm star terpolymers J. Chem. Phys. 2003, 118, 9861
22. He XH, Liang HJ & Pan CY Self-condensing vinyl polymerization in the presence of multifunctional initiator with unequal rate constants: Monte Carlo simulation Polymer 2003, 44, 6697
23. Huang L, He XH, Huang LS & Liang HJ Computer simulationon the self-assembly of associating polymers Polymer 2003, 44, 1967
24. He XH, Huang L, Liang HJ & Pan CY Self-assebly of star block copolymers by dynamic density functional theory J. Chem. Phys. 2002, 116, 10508
25. Liang HJ & Wang YY Influence of monomer types on the designability of a protein-model chain Chin. Phys. Lett. 2002, 19, 1382
26. He XH, Liang HJ, Song M & Pan CY Possibility of design of nanodevices by confined macromolecular self-assembly Macromol. Theor Simul. 2002, 11, 379
27. Wang YU, Chen HN, Liang HJ Monte Carlo simulation on the thermodynamic properties of a heteropolymer chain J. Chem. Phys. 2001, 115, 3951
28. He XH, Song M, Liang HJ & Pan CY Self-assembly of the symmetric diblock copolymer in a confined state: Monte Carlo simulation. J. Chem. Phys. 2001,114, 10510
29. He XH, Liang HJ & Pan CY Monte Carlo simulation of morphologies of self-assembled amphiphilic diblock copolymer in solution. Phys. Rev. E 2001, 63, 031804
30. He XH, Liang HJ & Pan CY Monte Carlo simulation of hyperbranched copolymerizations in the presence of a multifunctional initiator Macromol. Theor Simul. 2001, 10, 196
31. Liang HJ, Jiang W & He XH Monte Carlo simulation of pulsed-laser polymerization in emulsion Eur. Polym. J. 2000, 6, 2527
32. Liang HJ & Chen HN First-order transition of a homopolymer chain with Lennard-Jones potential J. Chem. Phys. 2000, 113, 4469
33. Liang HJ Designability of a protein chain in an off-lattice heteropolymer model J. Chem. Phys. 2000, 113, 4827
34. Liang HJ, Li FH & He XH Monte Carlo simulation for the modification of polymer via grafting Eur. Polym. J. 2000, 36, 1613
35. Liang HJ Observation of the molten globule state in a Monte Carlo simulation of the coil-to-globule transition of a homopolymer chain. J. Chem. Phys. 1999, 110, 10212
36. Liang HJ Compatibility of triblock copolymers in an A/B/copolymer ternary mixture Macromolecules 1999, 32, 8204
37. Liang HJ, He, XH, Jiang W & Jiang B. Monte Carlo simulation of phase separation of the A/B/A-B ternary mixture Macromol. Theory Simul. 1999, 8, 173