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- Currently displaying 18081 - 18100 of 29458 publications
INOR 857-Supramolecular functionalization: A method to construct and decorate isoreticular metal-organic frameworks
– ABSTR PAP AM CHEM S
(2007)
234,
PHYS 31-Redox free energies and one-electron energy levels from density functional theory based molecular dynamics
– ABSTR PAP AM CHEM S
(2007)
234,
ORGN 41-Quinoline oligoamide macrocycle: Selective G quadruplex binding ligand
– ABSTR PAP AM CHEM S
(2007)
234,
ORGN 20-Phase transfer dynamic combinatorial chemistry
– ABSTR PAP AM CHEM S
(2007)
234,
ORGN 121-Toward the total synthesis of azadirachtin
– ABSTR PAP AM CHEM S
(2007)
234,
Prediction of small molecule targets based on protein domains: Extrapolation into unknown target space
– ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234,
COMP 69-Is the surface of neat water neutral, acidic, or basic?
– ABSTR PAP AM CHEM S
(2007)
234,
PHYS 97-Density functional based molecular dynamics simulation of the aqueous hydroxyl and thiyl radical
– ABSTR PAP AM CHEM S
(2007)
234,
Crosslinking polymer brushes for the fabrication of quasi-2-D "micro-objects"
– ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(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
– ABSTR PAP AM CHEM S
(2007)
234,
INOR 472-Synthesis and characterization of a planar tetranuclear iron(II) complex and its conversion into linear triiron and paddlewheel diiron complexes
– ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234,
COMP 492-Caught in atomistic detailed action: Modeling of protein-G monomers forming oligomers
– ABSTR PAP AM CHEM S
(2007)
234,
Side effect profile prediction: Computational tackling of big pharma's worst nightmare at an early stage
– ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234,
Transmission of binding information across lipid bilayers
– Chemistry A European Journal
(2007)
13,
7215
(doi: 10.1002/chem.200601723)
Parallelizable split-operator propagator for treating Coriolis-coupled quantum dynamics
– Computer Physics Communications
(2007)
177,
357
(doi: 10.1016/j.cpc.2007.05.002)
The derivation of hydrogen‐containing radical concentrations from satellite data sets
– Quarterly Journal of the Royal Meteorological Society
(2007)
111,
993
(doi: 10.1002/qj.49711146605)
NMR, PDF and RMC study of the positive electrode material Li(Ni0.5Mn0.5) O2 synthesized by ion-exchange methods
– Journal of Materials Chemistry
(2007)
17,
3167
(doi: 10.1039/b702745a)
The nucleation of inosine : the impact of solution chemistry on the appearance of polymorphic and hydrated crystal forms
– Faraday discussions
(2007)
136,
179
(doi: 10.1039/b616164m)
Cocrystal architecture and properties: design and building of chiral and racemic structures by solid–solid reactions
– Faraday Discuss
(2007)
136,
167
(doi: 10.1039/b616399h)
Simulating ice nucleation, one molecule at a time, with the 'DFT microscope'
– Faraday Discussions
(2007)
136,
287
(doi: 10.1039/b616689j)