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- Currently displaying 13421 - 13440 of 29883 publications
Accounting for adsorption and desorption in lattice Boltzmann simulations
(2013)
(doi: 10.48550/arxiv.1303.2470)
Stacked triangular lattice: Percolation properties
Physical Review E
(2013)
87
032123
(doi: 10.1103/physreve.87.032123)
Solvate structures and computational/spectroscopic characterization of lithium difluoro(oxalato)borate (LiDFOB) electrolytes
The Journal of Physical Chemistry C
(2013)
117
5521
(doi: 10.1021/jp309102c)
Enantiomerically pure allylboronic esters as versatile reagents in the enantioselective synthesis of dihydro-α-pyrone-containing natural products
Synthesis Germany
(2013)
45
1106
(doi: 10.1055/s-0032-1318440)
Molecular dynamics simulations with replica-averaged structural restraints generate structural ensembles according to the maximum entropy principle
J Chem Phys
(2013)
138
094112
(doi: 10.1063/1.4793625)
Characterisation of Co@Fe 3 O 4 core@shell nanoparticles using advanced electron microscopy
Nanoscale
(2013)
5
5765
(doi: 10.1039/c3nr33789h)
Efficient softest mode finding in transition states calculations.
The Journal of Chemical Physics
(2013)
138
094110
(doi: 10.1063/1.4792644)
Conversion Reactions of Cadmium Chalcogenide Nanocrystal Precursors
Chemistry of Materials
(2013)
25
1233
(doi: 10.1021/cm3035642)
Water and Organic Synthesis: A Focus on the In-Water and On-Water Border. Reversal of the In-Water Breslow Hydrophobic Enhancement of the Normal endo-Effect on Crossing to On-Water Conditions for Huisgen Cycloadditions with Increasingly Insoluble Organic Liquid and Solid 2π-Dipolarophiles
The Journal of Organic Chemistry
(2013)
78
3276
(doi: 10.1021/jo400055g)
Monitoring the HIV-1 integrase enzymatic activity using atomic force microscopy in a 2LTR system.
Chemical Communications
(2013)
49
3113
(doi: 10.1039/c3cc40748a)
Mild and efficient synthesis of benzo-fused seven- and eight-membered ring lactams: A convenient approach to biologically interesting chemotypes
Synthetic Communications
(2013)
43
1508
(doi: 10.1080/00397911.2011.643439)
Atomistic and Coarse-Grained Molecular Dynamics Simulations of Membrane Proteins
(2013)
193
(doi: 10.1002/9781118523063.ch9)
Electrostatic Effects in Filamentous Protein Aggregation
Biophys J
(2013)
104
1116
(doi: 10.1016/j.bpj.2013.01.031)
Disagreement between theory and experiment grows with increasing rotational excitation of HD(v′, j′) product for the H + D2 reaction
Journal of Chemical Physics
(2013)
138
094310
(doi: 10.1063/1.4793557)
Controlling crystal self-assembly using a real-time feedback scheme
The Journal of chemical physics
(2013)
138
094502
(doi: 10.1063/1.4793527)
Organocatalytic domino reaction of cyanosulfones: access to complex cyclohexane systems with quaternary carbon centers.
Organic letters
(2013)
15
1386
(doi: 10.1021/ol400356k)
Dynamic combinatorial chemistry with novel dithiol building blocks: Towards new structurally diverse and adaptive screening collections
Synlett
(2013)
24
765
(doi: 10.1055/s-0032-1318407)
pH-Controlled Coordination Mode Rearrangements of “Clickable” Huisgen-Based Multidentate Ligands with [MI(CO)3]+ (M = Re, 99mTc)
Inorg Chem
(2013)
52
2939
(doi: 10.1021/ic302330u)
A surface site interaction model for the properties of liquids at equilibrium
Chemical Science
(2013)
4
1687
(doi: 10.1039/c3sc22124e)
Comprehensive Insights into the Structural and Chemical Changes in Mixed-Anion FeOF Electrodes by Using Operando PDF and NMR Spectroscopy
Journal of the American Chemical Society
(2013)
135
4070
(doi: 10.1021/ja400229v)
