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  • Currently displaying 19361 - 19380 of 30651 publications
Author(s)
Publication title
Journal Name
Publication year
PHYS 342-Heterogeneous asymmetric hydrogenation of C=C bonds
DJ Watson, RBR John-Jesudason, AI McIntosh, DC Madden, JW Burton, RM Lambert
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
Prediction of small molecule targets based on protein domains: Extrapolation into unknown target space
JL Jenkins, A Bender, D Mikhailov
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
ORGN 260-Studies toward the total synthesis of reidispongiolide A
I Paterson, G Cecere, GJ Florence, G Chouraqui, J Stafford, K Ashton, R Britton
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
"Phylochemical Tree" for drug targets: Putting biological activities into context via ligand-based similarity measures
A Bender, JL Jenkins, JW Davies
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
COMP 495-Tautomers, conformers, and computation of chemical similarity
JH Nettles, JL Jenkins, Z Deng, A Bender, J Scheiber, JW Davies, M Glick
ABSTR PAP AM CHEM S
(2007)
234
INOR 899-Electron-transfer activation of anionic ruthenium(III) anticancer drugs
E Reisner, VB Arion, BK Keppler, AJL Pombeiro
ABSTR PAP AM CHEM S
(2007)
234
ORGN 20-Phase transfer dynamic combinatorial chemistry
R Perez-Fernandez, JKM Sanders
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
PHYS 97-Density functional based molecular dynamics simulation of the aqueous hydroxyl and thiyl radical
M Sprik, C Adriaanse, M Sulpizi, J VandeVondele
ABSTR PAP AM CHEM S
(2007)
234
Exploring energy landscapes with explicit and implicit water
DJ Wales
ABSTR PAP AM CHEM S
(2007)
234
ORGN 121-Toward the total synthesis of azadirachtin
A Boyer, E Beckmann, GE Veitch, BJ Burke, SV Ley
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
Crosslinking polymer brushes for the fabrication of quasi-2-D "micro-objects"
JE Comrie, WTS Huck
ABSTR PAP AM CHEM S
(2007)
234
PHYS 99-Water addition along with reduction of aqueous ruthenium complexes by ab initio free energy calculation method for bond breaking/formation coupled to electron transfer
Y Tateyama, J Blumberger, T Ohno, M Sprik
ABSTR PAP AM CHEM S
(2007)
234
PHYS 31-Redox free energies and one-electron energy levels from density functional theory based molecular dynamics
M Sprik, R Ayala, J VandeVondele
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
Unexpected relaxation dynamics of a self-avoiding polymer in cylindrical confinement
A Arnold, B Bozorgui, D Frenkel, B-Y Ha, S Jun
(2007)
Transmission of binding information across lipid bilayers.
HP Dijkstra, JJ Hutchinson, CA Hunter, H Qin, S Tomas, SJ Webb, NH Williams
Chemistry – A European Journal
(2007)
13
Parallelizable split-operator propagator for treating Coriolis-coupled quantum dynamics
MT Cvitas, SC Althorpe
Computer Physics Communications
(2007)
177
The derivation of hydrogen‐containing radical concentrations from satellite data sets
JA Pyle, AM Zavody
Quarterly Journal of the Royal Meteorological Society
(2007)
111
Cocrystal architecture and properties: Design and building of chiral and racemic structures by solid-solid reactions
T Friscić, W Jones
Faraday Discuss
(2007)
136
NMR, PDF and RMC study of the positive electrode material Li(Ni0.5Mn0.5) O2 synthesized by ion-exchange methods
J Bréger, K Kang, J Cabana, G Ceder, CP Grey
Journal of Materials Chemistry
(2007)
17
The nucleation of inosine: the impact of solution chemistry on the appearance of polymorphic and hydrated crystal forms
RA Chiarella, AL Gillon, RC Burton, RJ Davey, G Sadiq, A Auffret, M Cioffi, CA Hunter
Faraday Discuss
(2007)
136