fralium's library 17 articles Export

	Tetramerization domain of human butyrylcholinesterase is at the C-terminus. [My Copy] Biochem J., Vol. 327 (1997), pp. 747-757. posted to tetramer by fralium on 2009-11-20 14:35:02 as
	Controlled Concealment of Exposed Clearance and Immunogenic Domains by Site-specific Polyethylene Glycol Attachment to Acetylcholinesterase Hypolysine Mutants [My Copy] Journal of Biological Chemistry, Vol. 282, No. 49. (7 December 2007), pp. 35491-35501. by Ofer Cohen, Chanoch Kronman, Arie Lazar, Baruch Velan, Avigdor Shafferman posted to pegylation by fralium on 2009-11-19 16:46:55 as
	Proton Binding to Proteins: pKa Calculations with Explicit and Implicit Solvent Models [My Copy] Journal of the American Chemical Society, Vol. 126, No. 13. (1 April 2004), pp. 4167-4180. by Thomas Simonson, Jens Carlsson, David A. Case posted to pka by fralium on 2009-10-21 21:51:23 as along with 5 people and 1 group flbarroso 6rheology sobolevnrm RamuAnandakrishnan dmobley baker-group
	Molecular dynamics simulations of human butyrylcholinesterase [My Copy] Proteins: Structure, Function, and Bioinformatics, Vol. 59, No. 1. (2005), pp. 104-117. by Dimas Suárez, Martin J. Field posted to gate bche by fralium on 2009-10-20 16:08:54 as
	Comparison of simple potential functions for simulating liquid water [My Copy] The Journal of Chemical Physics, Vol. 79, No. 2. (1983), pp. 926-935. by William L. Jorgensen, Jayaraman Chandrasekhar, Jeffry D. Madura, Roger W. Impey, Michael L. Klein posted to principle amber by fralium on 2009-09-24 15:37:18 as along with 17 people and 1 group jmparks bmduggan kulinskii ibuch Lombardo_7 paddydu dfgreen softsimu mleis ttjoseph ffranca easybakemuffin ashaytan RamuAnandakrishnan r2s2 pavanghatty Diego_Prada CMB
	Role of the Catalytic Triad and Oxyanion Hole in Acetylcholinesterase Catalysis: An ab initio QM/MM Study [My Copy] Journal of the American Chemical Society, Vol. 124, No. 35. (1 September 2002), pp. 10572-10577. by Yingkai Zhang, Jeremy Kua, J. Andrew Mccammon posted to ache ach by fralium on 2009-09-01 22:00:02 as
	Complete amino acid sequence of human serum cholinesterase [My Copy] J. Biol. Chem., Vol. 262, No. 2. (15 January 1987), pp. 549-557. by O. Lockridge, C. F. Bartels, T. A. Vaughan, C. K. Wong, S. E. Norton, L. L. Johnson posted to bche by fralium on 2009-08-28 17:18:30 as
	Free-Energy Perturbation Simulation on Transition States and Redesign of Butyrylcholinesterase [My Copy] Vol. 96, No. 5. (4 March 2009), pp. 1931-1938. by Wenchao Yang, Yongmei Pan, Fang Zheng, Hoon Cho, Hsin-Hsiung Tai, Chang-Guo Zhan posted to fep by fralium on 2009-08-14 15:49:40 as
	X-ray structures of Torpedo californica acetylcholinesterase complexed with (+)-huperzine A and (-)-huperzine B: structural evidence for an active site rearrangement. [My Copy] Biochemistry, Vol. 41, No. 35. (3 September 2002), pp. 10810-10818. by H. Dvir, H. L. Jiang, D. M. Wong, et al.M. Harel, M. Chetrit, X. C. He, G. Y. Jin, G. L. Yu, X. C. Tang, I. Silman, D. L. Bai, J. L. Sussman posted to ache by fralium on 2009-07-29 20:39:45 as
	Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase. [My Copy] Biophysical journal, Vol. 81, No. 2. (August 2001), pp. 715-724. by K. Tai, T. Shen, U. Börjesson, M. Philippopoulos, J. A. McCammon posted to ache gate by fralium on 2009-07-02 15:07:52 as along with 1 person saravan
	Mouse acetylcholinesterase unliganded and in complex with huperzine A: A comparison of molecular dynamics simulations [My Copy] Biopolymers, Vol. 50, No. 1. (1999), pp. 35-43. by Sylvia Tara, T. P. Straatsma, J. Andrew Mccammon posted to ache gate by fralium on 2009-07-02 15:04:23 as
	How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules? [My Copy] Journal of Computational Chemistry, Vol. 21, No. 12. (2000), pp. 1049-1074. by Junmei Wang, Piotr Cieplak, Peter A. Kollman posted to no-tag by fralium on 2009-05-27 15:40:46 as along with 5 people and 1 group dsmueller pavanghatty A_Coletta_Thesis allmensch rabio Structural Biology Group TorVergata
	Solvation effects [My Copy] Protein Engineering Design and Selection, Vol. 2 (1989), pp. 319-327. by Richards posted to effect solvation by fralium on 2009-05-19 14:35:51 as
	New algorithms and an in silico benchmark for computational enzyme design. [My Copy] Protein Sci, Vol. 15, No. 12. (December 2006), pp. 2785-2794. by A. Zanghellini, L. Jiang, A. M. Wollacott, et al.G. Cheng, J. Meiler, E. A. Althoff, D. Röthlisberger, D. Baker posted to algorithms by fralium on 2009-04-27 15:04:02 as along with 1 person jwm
	Kemp elimination catalysts by computational enzyme design [My Copy] Nature, Vol. 453, No. 7192. (19 March 2008), pp. 190-195. by Daniela Rothlisberger, Olga Khersonsky, Andrew M. Wollacott, et al.Lin Jiang, Jason DeChancie, Jamie Betker, Jasmine L. Gallaher, Eric A. Althoff, Alexandre Zanghellini, Orly Dym, Shira Albeck, Kendall N. Houk, Dan S. Tawfik, David Baker posted to computational de design novo by fralium on 2009-04-24 20:21:29 as along with 12 people and 3 groups barmak7282 baiaixi whitead qbin1304 Diego_Prada apaydin jwm msuarezdiez austin cactus neils sobolevnrm Jiang Research Group Biocatalysis and Biotransformation baker-group
	De Novo Computational Design of Retro-Aldol Enzymes [My Copy] Science, Vol. 319, No. 5868. (7 March 2008), pp. 1387-1391. by Lin Jiang, Eric A. Althoff, Fernando R. Clemente, et al.Lindsey Doyle, Daniela Rothlisberger, Alexandre Zanghellini, Jasmine L. Gallaher, Jamie L. Betker, Fujie Tanaka, Carlos F. Barbas, Donald Hilvert, Kendall N. Houk, Barry L. Stoddard, David Baker posted to computational de design novo by fralium on 2009-04-24 20:16:05 as along with 17 people and 4 groups barmak7282 baiaixi qbin1304 alexknight barry aalibes jwm aprasad dgront zwang sobolevnrm davidlott msuarezdiez scienbox ucbcjbm joseph_x_zhou cambray Biocatalysis and Biotransformation structural_bioinformatics baker-group McCammon
	Transition-State Docking of Flunitrazepam and Progesterone in Cytochrome P450 [My Copy] Journal of Chemical Theory and Computation, Vol. 4, No. 4. (1 April 2008), pp. 673-681. by Patrik Rydberg, Sine M. Hansen, Jacob Kongsted, Per-Ola Norrby, Lars Olsen, Ulf Ryde posted to docking state transition by fralium on 2009-04-07 19:27:38 as along with 2 people ucbcjbm vaibhavdixit4