IUCr XVII Abstract Listing for session 22.01

Session Chair: Carolyn Pratt Brock
Dept. Of Chemistry
Univ. Of Kentucky
Lexington KY 40506-0055
Phone: 606 257 1959
Fax: 606 323 1069
cpbrock@ukcc.uky.edu

Program Contact: J. Flippen
Lab for the Structure of Matter
Code 6030
Naval Research Lab
Washington DC 20375
FAX 202 767 6874
flippen@harker.nrl.navy.mil

(E0294) MS22.01.01
Date: Friday, August 9, Time: 10:00 - 10:25, Room: 6A
THE USE OF MULTIPLE DATABASES IN PRACTICAL MATERIALS IDENTIFICATION PROBLEMS
James Kaduk
kaduk@amoco.com

(S0216) MS22.01.02
Date: Friday, August 9, Time: 10:25 - 10:50, Room: 6A
COORDINATION OF LEAD (Pb) IN CRYSTAL STRUCTURES: A CAMBRIDGE STRUCTURAL DATABASE STUDY
Liat Shimoni-Livny , Charles W. Bock and Jenny P. Glusker
l_shimoni@fccc.edu

(S0549) MS22.01.03
Date: Friday, August 9, Time: 10:50 - 11:15, Room: 6A
STATISTICAL HYDROGEN BOND STUDIES BASED ON NEUTRON DIFFRACTION DATA
Thomas Steiner
steiner@chemie.fu-berlin.de

(S0226) MS22.01.04
Date: Friday, August 9, Time: 11:15 - 11:40, Room: 6A
A KNOWLEDGE BASE OF DERIVED INFORMATIOM FROM THE CAMBRIDGE STRUCTURAL DATABASE: NON-BONDED INTERACTIONS
Jason C. Cole , Frank H. Allen, Jos P. M. Lommerse, R. Scott Rowland and Robin Taylor
cole@chemcrys.cam.ac.uk

(E0055) MS22.01.05
Date: Friday, August 9, Time: 11:40 - 12:05, Room: 6A
A DATABASE STUDY OF THE BONDING AND CONFORMATION OF BIS-SULFONYLAMIDES AND IMIDES
Alajos Kalman and Petra Bombicz
akalman@cric.chemres.hu

(E1003) MS22.01.06
Date: Friday, August 9, Time: 12:05 - 12:30, Room: 6A
AUTOMATIC DETERMINATION OF STRUCTURAL SUBCLASSES
Shishan Guo , Suzanne Fortier and Janice I. Glasgow
shishan@chem.queensu.ca

(S0225) PS22.01.07
Session: I, Board: 355, Room: Not Yet Assigned
PLUTO: CRYSTAL PACKING ENERGIES IN THE CAMBRIDGE STRUCTURAL DATABASE
Sam Motherwell
wdsm@chemcrys.cam.ac.uk

(S0224) PS22.01.08
Session: I, Board: 356, Room: Not Yet Assigned
PREQUEST: A DATA INPUT PROGRAM FOR THE CAMBRIDGE STRUCTURAL DATABASE
Paul Edgington , Clare Macrae and Sam Motherwell
preio@chemcrys.cam.ac.uk

(E0957) PS22.01.09
Session: I, Board: 357, Room: Not Yet Assigned
STRUCTURAL LIBRARY OF COMMONLY DISORDERD COUNTER IONS AND INCLUDED MOLECULES ESTABISHMENT OF SELECTION CRITERIA AND METHODOLOGY
Richard J. Staples and Joseph H. Reibenspies
rstaples@uidaho.edu

(S0256) PS22.01.10
Session: I, Board: 358, Room: Not Yet Assigned
INTERMOLECULAR INTERACTIONS A FIVE MEMBERED RING PATTERN CONTAINING HALOGEN HALOGEN AND HALOGEN HYDROGEN INTERACTIONS
Oshrit Navon and Joel Bernstein
navon@cryst.bgumail.bgu.ac.il

(E1342) PS22.01.11
Session: I, Board: 359, Room: Not Yet Assigned
TURN AND HELIX MIMETICS FOR PEPTIDE DESIGN
Anke Mueller-Fahrnow and Ursula Egner
anke.muellerfahrnow@schering.de

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