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Rev., 12 ƪJACS(1ƪperspective), 1ƪWiley¿çѧ¿Æ×ÛÊö(IF:9.0), ºÍ2ƪAngew. Chem. Int. Ed.¡¿ºÍ3ƪWileyÊé¼®Õ½ڡ£3ƪÂÛÎı»RIKEN Research, Curr. Opin. Chem. Biol.ºÍNature ChinaÁÁµã¡£ÂÛÎı»ISIÒýÓÃ727Óà´Î£¨H-index: 17£©¡£ÔÚÇâ¹è»¯/ȲÌþ²åÈ루Îâ-Trost»úÀí£©¡¢É«°±ËáË«¼ÓÑõø¡¢Ó©»ð³æ·¢¹â»úÀíºÍÓ«¹âµ°°×µÈÑо¿ÖУ¬Ìá³öÁËеķ´Ó¦»úÀí¡£Í¬Ê±²ÎÓ뿪·¢ºÍÓ¦ÓÃеķǾøÈÈ·Ö×Ó¶¯Á¦Ñ§Ä£Äâ·½·¨£¬Ñо¿¹âÉúÎïÌåϵµÄ¹â¶¯Á¦Ñ§¹ý³Ì¡£13Äê11Ô±»ÑûÇëµ½µÚËĽìÑÇÖÞÅäλ»¯Ñ§»áÒé×öÑûÇ뱨¸æ¡£ 2013Äê10ÔÂÊÜƸÓÚÄÏ·½¿Æ¼¼´óѧ»¯Ñ§Ïµ¸±Ñо¿Ô±, ¿ÎÌâ×鳤£¬¼Æ»®½¨Á¢Ò»¸ö¸ßÖÊÁ¿¸ßˮƽµÄÑо¿×飬ͬʱÓë±±¾©´óѧÉîÛÚÑо¿ÉúÔº¼ÆË㻯ѧÓëÒ©ÎïÉè¼ÆÖصãʵÑéÊÒÓнôÃܵĽ»Á÷¡¢ºÏ×÷ºÍÅàÓý£¬ÒÔ¼°ÓëÊÀ½çÒ»Á÷µÄÑо¿×éºÏ×÷ºÍ½»Á÷·ÃÎÊ¡£Ä¿Ç°¼Æ»®ÕÐƸÊýÃûÑо¿ÖúÀí/ʵÑéÔ±/Research Fellow£¬»¶Ó­ÓÐÖ¾ÓÚ´Óʸ´ÔÓϵͳģÄâÑо¿¡¢×·ÇóѧÊõ׿Խ¡¢ÓÂÓÚ½ÓÊÜÌôÕ½ÓÅÐãÈ˲żÓÈë¡£ÄÏ¿Æ´óÕýÉêÇëÑо¿ÉúÕÐÉúµã£¬Åú×¼ºó£¬Ñо¿ÖúÀíÔ­ÔòÉÏ¿ÉתΪÑо¿Éú¡£ ÏêÇé¿É·ÃÎÊÒÔÏÂÍøÕ¾ http://www.sustc.edu.cn/index.php?r=blog/index&id=77 Selected Publications: 1. Chung, L. W.; Wu, Y.-D.;* Trost, B. M.;* Ball, Z. T. ¡°A Theoretical Study on the Mechanism, Regiochemistry, and Stereochemistry of Hydrosilylation Catalyzed by Cationic Ruthenium Complexes¡± J. Am. Chem. Soc. 2003, 125, 11578. 2. Miao, W.; Chung. L. W.; Wu, Y.-D; Chan, T. H.* ¡°Experimental and Theoretical Studies of the Propargl-Allenylindium System¡± J. Am. Chem. Soc. 2004, 126, 13326. 3. Chung, L. W.; Li, X.; Sugimoto, H.; Shiro, Y.; Morokuma, K.* ¡°Density Functional Theory Study on a Missing Piece in Understanding of Heme Chemistry: The Reaction Mechanism for Indoleamine 2,3-Dioxygenase and Tryptophan 2,3-Dioxygenase¡± J. Am. Chem. Soc. 2008, 130, 12299. 4. Chung, L. W.; Hayashi, S.; Lundberg, M.; Nakatsu, T.; Kato, H.; Morokuma, K.* ¡°Mechanism of Efficient Firefly Bioluminescence via Adiabatic Transition State and Seam of Sloped Conical Intersection¡± J. Am. Chem. Soc. (Commun.) 2008, 130, 12880. 5. Li, X.; Chung, L. W.; Paneth, P.; Morokuma, K.* ¡°DFT and ONIOM(DFT:MM) Studies on Co-C Bond Cleavage and Hydrogen Transfer in B12-Dependent Methylmalonyl-CoA Mutase. Stepwise or Concerted Mechanism?¡± J. Am. Chem. Soc. 2009, 131, 5115. 6. Noda, S.; Nakamura, A.; Kochi, T.; Chung, L. W.; Morokuma, K.;* Nozaki, K.* ¡°Mechanistic Studies on the Formation of Linear Polyethylene Chain Catalyzed by Palladium Phosphine−Sulfonate Complexes: Experiment and Theoretical Studies¡± J. Am. Chem. Soc. 2009, 131, 14088. 7. Li, X.; Chung, L. W.; Mizuno, H.; Miyawaki, A.; Morokuma, K.* ¡°A Theoretical Study on the Nature of On- and Off-States of Reversibly Photoswitching Fluorescent Protein Dronpa: Absorption, Emission, Protonation and Raman¡± J. Phys. Chem. B 2010, 114, 1114. 8. Chung, L. W.; Li, X.; Sugimoto, H.; Shiro, Y.; Morokuma, K.* ¡°ONIOM Study on a Missing Piece in Our Understanding of Heme Chemistry: Bacterial Tryptophan 2,3-Dioxygenase with Dual Oxidants¡± J. Am. Chem. Soc. 2010, 132, 11993. 9. Nozaki, K.;* Kusumoto, S.; Noda, S.; Kochi, T.; Chung, L. W.; Morokuma, K.;* ¡°Why Did Incorporation of Acrylonitrile to a Linear Polyethylene Become Possible? Comparison of Phosphine‒Sulfonate Ligand with Diphosphine and Imine‒Phenolate Ligands in the Pd-Catalyzed Ethyelene/Acrylonitrile Copolymerization¡± J. Am. Chem. Soc. 2010, 132, 16030.10. 10. Li, X.; Chung, L. W.; Mizuno, H.; Miyawaki, A.; Morokuma, K.* ¡°Primary Events of Photodynamics in Reversible Photoswitching Fluorescent Protein Dronpa¡± J. Phys. Chem. Lett. 2010, 1, 3328. 11. Nakamura, A.; Munakata, K.; Ito, S.; Kochi, T.; Chung, L. W.; Morokuma, K.;* Nozaki, K.* ¡°Pd-Catalyzed Copolymerization of Methyl Acrylate with Carbon Monoxide: Structures, Properties and Mechanistic Aspects toward Ligand Design¡± J. Am. Chem. Soc. 2011, 133, 6761. 12. Li, X.; Chung, L. W.;* Morokuma,* K. ¡°Photodynamics of All-trans Retinal Protonated Schiff Base in Bacteriorhodopsin and Methanol Solution¡± J. Chem. Theory Comput. (Lett.) 2011, 7, 2694. 13. Chung, L. W.;* Li, X.; Hirao, H.; Morokuma, K.* ¡°Comparative Reactivity of Ferric-Superoxo and Ferryl-Oxo Species in Heme and Non-Heme Complexes¡± J. Am. Chem. Soc. (Commun.) 2011, 133, 20076. 14. Chung, L. W.; Hirao, H.; Li, X.; Morokuma, K.* ¡°The ONIOM Method: Its Foundation and Applications to Metalloenzymes and Photobiology¡±, Wiley Interdisciplinary Reviews: Comput. Mol. Sci. 2012, 2, 327. 15. Ding, S.; Song, L.-J.; Chung, L. W.; Zhang, X.; Sun, J.;* Wu, Y.-D.* ¡°Ligand-Controlled Remarkable Regio- and Stereodivergence in Intermolecular Hydrosilylation of Internal Alkynes: Experimental and Theoretical Studies¡±, J. Am. Chem. Soc. 2013, 135, 13835. 16. Mei, G.; Yuan, H.; Gu, Y.; Chen, W.; Chung, L. W.; Li, C.-C.* ¡°Dearomative Indole [5+2] Cycloaddition Reactions: Stereoselective Synthesis of Highly Functionalized Cycloheptabindoles¡±, Angew. Chem. Int. Ed. 2014, 53, 11051. 17. Cheng, G.-J.; Zhang, X.;Chung, L. W.; Xu, L.; Wu, Y.-D.* ¡°Computational Organic Chemistry: Bridging Theory and Experiment in Establishing the Mechanisms of Chemical Reactions", J. Am. Chem. Soc. (Perspective) 2015, DOI: 10.1021/ja5112749. 18. Ding, S.; Song, L.-J.; Wang, Y.; Zhang, X.;* Chung, L. W.;* Wu, Y.-D.;* Sun, J.* ¡°Highly Regio- and Stereoselective Hydrosilylation of Internal Thioalkynes Under Mild Conditions¡±, Angew. Chem. Int. Ed. 2015, DOI: 10.1002/anie.201500372. 19. Chung, L. W.; Sameera, W. M. C.; Ramozzi,R.; Page, A. J.; Hatanaka, M.; Petrova, G. P.; Harris, T. V.; Li, X.; Ke, Z.; Liu, F.; Li, H.-B.; Ding, L. Morokuma, K.*; ¡°The  ONOIM Method and its Applications¡±, Chem. Rev. 2015, DOI: 10.1021/cr5004419 (invited for a special issue: ¡°Calculations on Large Systems" [ Last edited by choscar on 2015-4-2 at 19:38 ]

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