IUCr XVII Abstract Listing for session 03.04

Session Chair: K. Wilson
Dept. Of Chemistry
Unviersity Of York
Heslington
York YOP1 5DD UK
Phone: 01904 432519
Fax: 01904 410519
keith@embl-hamburg.de

Program Contact: L. Johnson
Univ Of Oxford
Rex Richards Bldg
South Parks Rd
Oxford
UK
FAX 0865 510454
louise@biop.ox.ac.uk

(E1444) MS03.04.01
Date: Wednesday, August 14, Time: 3:45 - 4:10, Room: 602-604
OVERVIEW OF REFINEMENT AND LEASE-SQUARES METHODS
Dale E. Tronrud
dale@uoxray.uoregon.edu

(D0102) MS03.04.02
Date: Wednesday, August 14, Time: 4:10 - 4:35, Room: 602-604
REFINEMENT OF PROTEINS AT ATOMIC RESOLUTION
Victor S. Lamzin , Thomas R. Schneider, Zbigniew Dauter and Keith S. Wilson
victor@embl-hamburg.de

(S0283) MS03.04.03
Date: Wednesday, August 14, Time: 4:35 - 5:00, Room: 602-604
CRYSTALLOGRAPHIC STRUCTURE REFINEMENT USING MOLECULAR DYNAMICS CONSTRAINED TO TORSION ANGLES
Luke M Rice and Axel T. Br�nger
luke@laplace.csb.yale.edu

(E0747) MS03.04.04
Date: Wednesday, August 14, Time: 5:00 - 5:25, Room: 602-604
Au or FeS2? VALIDATION OF PROTEIN MODELS AND REFINEMENT PROTOCOLS
Gerard J. Kleywegt and T. Alwyn Jones

(E0106) MS03.04.05
Date: Wednesday, August 14, Time: 5:25 - 5:45, Room: 602-604
IMPROVED STRUCTURE REFINEMENT THROUGH MAXIMUM LIKELIHOOD
Randy J. Read and Navraj S. Pannu
rndy@mycroft.mmid.ualberta.ca

(E1060) MS03.04.06
Date: Wednesday, August 14, Time: 5:45 - 6:00, Room: 602-604
DESCRIPTION OF PROGRAM USING MAXIMUM LIKELIHOOD RESIDUAL FOR MACROMOLECULAR REFINEMENT, ILLUSTRATED BY SEVERAL EXAMPLES
Eleanor J. Dodson , Garib N. Murshufov and Alexei A. Vagin
ccp4@yorvic.york.ac.uk

(S0275) PS03.04.07
Session: III, Board: 032, Room: Not Yet Assigned
PROTEIN PRECISION RE-EXAMINED: LUZZATI PLOTS DO NOT ESTIMATE FINAL ERRORS
D. W. J. Cruickshank
hell@man.ac.uk

(E1186) PS03.04.08
Session: III, Board: 033, Room: Not Yet Assigned
A NEW APPROACH TO MACROMOLECULAR REFIENEMENT VIA BAYES' LAW AND BOLTZMANN'S DISTRIBUTION
Rob Grothe
robg@theseus.wustl.edu

(E1392) PS03.04.09
Session: III, Board: 034, Room: Not Yet Assigned
HYDROPHILICITY OF CAVITIES IN PROTEINS
Jan Hermans , Li Zhang, Christopher Van Deusen and Xinfu Xia
hermans@med.unc.edu

(E0327) PS03.04.10
Session: III, Board: 035, Room: Not Yet Assigned
MULTICOPY MODELING OF THE SOLVENT DISTRIBUTION IN MACROMOLECULAR CRYSTALS
Eduardo I. Howard , J. Raul Grigera, Alberto D. Podjarny and Alexander Urzhumtsev
grigera@iflysi@edu.ar

(E1318) PS03.04.11
Session: III, Board: 036, Room: Not Yet Assigned
A TEST OF MAXIMUM-LIKELIHOOD REFINEMENT OF MACROMOLECULAR STRUCTURES WITH BUSTER & TNT
John Irwin and Gerard Bricogne
ji10@mrc-lmb.cam.ac.uk

(E1099) PS03.04.12
Session: III, Board: 037, Room: Not Yet Assigned
MACROMOLECULAR ANISOTROPIC TEMPERATURE-FACTOR REFINEMENT WITH STRICT CONSTRAINTS
Jennifer A. Kelly and Todd Yeates
kelly@ampere.mbi.ucla.edu

(E1108) PS03.04.13
Session: III, Board: 038, Room: Not Yet Assigned
PREDICTING AND ANALYZING DETERMINANTS OF WATER-MEDIATED LIGAND RECOGNITION
Leslie A. Kuhn , Michael L. Raymer, William F. Punch, Paul C. Sanschagrin and Erik D. Goodman
kuhn@agua.bch.msu.edu

(E0674) PS03.04.14
Session: III, Board: 039, Room: Not Yet Assigned
AN INTENSITY-BASED LIKELIHOOD FUNCTION FOR STRUCTURE REFINEMENT
Navraj S. Pannu and Randy J. Read
raj@mycroft.mmid.ualberta.ca

(D0037) PS03.04.15
Session: III, Board: 040, Room: Not Yet Assigned
CRYSTAL STRUCTURE AT 10 � RESOLUTION OF HUMAN p56lck DOMAIN IN COMPLEX WITH A SHORT PHOSPHOTYROSYL PEPTIDE
L. Tong , T. C. Warren, J. King, R. Betageri, J. Rose and S. Jakes

(E0483) PS03.04.16
Session: III, Board: 041, Room: Not Yet Assigned
LOCAL INDICATORS OF MODEL QUALITY
G. Zhou , E. Blanc and M. S. Chapman
genfa@his.sb.fsu.edu

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