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- Currently displaying 10521 - 10540 of 29403 publications
Insights into the structure of many-electron wave functions of Mott-insulating antiferromagnets: The three-band Hubbard model in full configuration interaction quantum Monte Carlo
– Physical Review B
(2015)
91,
045139
(doi: 10.1103/physrevb.91.045139)
Improving the photocatalytic reduction of CO2 to CO through immobilisation of a molecular Re catalyst on TiO2.
– Chemistry
(2015)
21,
3746
(doi: 10.1002/chem.201405041)
Model-free estimation of the effective correlation time for C-H bond reorientation in amphiphilic bilayers: (1)H-(13)C solid-state NMR and MD simulations.
– J Chem Phys
(2015)
142,
044905
(doi: 10.1063/1.4906274)
Toward a benchmarking data set able to evaluate ligand- and structure-based virtual screening using public HTS data.
– Journal of Chemical Information and Modeling
(2015)
55,
343
(doi: 10.1021/ci5005465)
Novel encoding methods for DNA-templated chemical libraries.
– Current Opinion in Chemical Biology
(2015)
26,
25
(doi: 10.1016/j.cbpa.2015.01.004)
Electrochemical selenium-and iodonium-initiated cyclisation of hydroxy-functionalised 1,4-dienes
– Beilstein journal of organic chemistry
(2015)
11,
174
(doi: 10.3762/bjoc.11.18)
Parahydrogen-Induced Polarization by Pairwise Replacement Catalysis on Pt and Ir Nanoparticles
– J Am Chem Soc
(2015)
137,
1938
(doi: 10.1021/ja511476n)
Influence of aerosol chemical composition on N2O5 uptake: Airborne regional measurements in northwestern Europe
– Atmospheric Chemistry and Physics
(2015)
15,
973
(doi: 10.5194/acp-15-973-2015)
Studies on the catalytic domains of multiple JmjC oxygenases using peptide substrates.
– Epigenetics
(2015)
9,
1596
(doi: 10.4161/15592294.2014.983381)
Supersaturation is a major driving force for protein aggregation in neurodegenerative diseases.
– Trends in pharmacological sciences
(2015)
36,
72
(doi: 10.1016/j.tips.2014.12.004)
Aging of secondary organic aerosol generated from the ozonolysis of α-pinene: effects of ozone, light and temperature
– Atmospheric Chemistry and Physics
(2015)
15,
883
(doi: 10.5194/acp-15-883-2015)
Elucidation of the Local and Long-Range Structural Changes that Occur in Germanium Anodes in Lithium-Ion Batteries
– Chemistry of Materials
(2015)
27,
1031
(doi: 10.1021/cm504312x)
Understanding “On-Water” Catalysis of Organic Reactions. Effects of H+ and Li+ Ions in the Aqueous Phase and Nonreacting Competitor H‑Bond Acceptors in the Organic Phase: On H2O versus on D2O for Huisgen Cycloadditions
– The Journal of Organic Chemistry
(2015)
80,
1809
(doi: 10.1021/jo502732y)
Targeting the Achilles heel of the hepatitis B virus: a review of current treatments against covalently closed circular DNA.
– Drug discovery today
(2015)
20,
548
(doi: 10.1016/j.drudis.2015.01.008)
Entropic factors also contribute to the high melting points of polyhedral alkanes.
– Nat Chem
(2015)
7,
89
(doi: 10.1038/nchem.2146)
Conjugated polymer-porphyrin complexes for organic electronics.
– Chemphyschem
(2015)
16,
1223
(doi: 10.1002/cphc.201402759)
Flow chemistry: Intelligent processing of gas-liquid transformations using a tube-in-tube reactor
– Accounts of chemical research
(2015)
48,
349
(doi: 10.1021/ar500359m)
A high transmission wave-guide wire network made by self-assembly
– Nanoscale
(2015)
7,
1032
(doi: 10.1039/c4nr04485a)