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- Currently displaying 10181 - 10200 of 31132 publications
In Silico Prediction of Chemicals Binding to Aromatase with Machine Learning Methods
Chemical research in toxicology
(2017)
30
1209
Investigating the role of boundary bricks in DNA brick self-assembly
(2017)
(doi: 10.48550/arxiv.1704.08293)
Fe-catalyzed synthesis of (4Z)-alkenoates
Russian Journal of General Chemistry
(2017)
87
569
(doi: 10.1134/s1070363217030306)
Is CuII Coordinated to Patellamides inside Prochloron Cells?
Chemistry – A European Journal
(2017)
23
12264
(doi: 10.1002/chem.201700895)
Projector Quantum Monte Carlo Method for Nonlinear Wave Functions.
Physical review letters
(2017)
118
176403
Amyloid fibril systems reduce, stabilize and deliver bioavailable nanosized iron.
Nature nanotechnology
(2017)
12
642
(doi: 10.1038/NNANO.2017.58)
Metadynamic metainference: Convergence towards force field independent structural ensembles of a disordered peptide.
The Journal of chemical physics
(2017)
146
165102
(doi: 10.1063/1.4981211)
Structure of the Fundamental Lipopeptide Surfactin at the Air/Water Interface Investigated by Sum Frequency Generation Spectroscopy
The Journal of Physical Chemistry B
(2017)
121
5072
(doi: 10.1021/acs.jpcb.7b03476)
Performance of van der Waals Corrected Functionals for Guest Adsorption in the M2(dobdc) Metal-Organic Frameworks.
The Journal of Physical Chemistry A
(2017)
121
4139
(doi: 10.1021/acs.jpca.7b00076)
Mechanism and Origins of Stereoselectivity in the Cinchona Thiourea- and Squaramide-Catalyzed Asymmetric Michael Addition of Nitroalkanes to Enones
Journal of Organic Chemistry
(2017)
82
4396
(doi: 10.1021/acs.joc.7b00521)
Direct radiative effect of carbonaceous aerosols from crop residue burning during the summer harvest season in East China
Atmospheric Chemistry and Physics
(2017)
17
5205
(doi: 10.5194/acp-17-5205-2017)
Metal-Organic Nanosheets Formed via Defect-Mediated Transformation of a Hafnium Metal-Organic Framework.
J Am Chem Soc
(2017)
139
5397
(doi: 10.1021/jacs.7b00106)
Inside Cover: Gas‐Phase Vibrational Spectroscopy of the Aluminum Oxide Anions (Al2O3)1–6AlO2− (ChemPhysChem 8/2017)
ChemPhysChem
(2017)
18
866
(doi: 10.1002/cphc.201700336)
Water-Ice Analogues of Polycyclic Aromatic Hydrocarbons: Water Nanoclusters on Cu(111)
J Am Chem Soc
(2017)
139
6403
(doi: 10.1021/jacs.7b01883)
The role of cracks in the crystal nucleation process of amorphous griseofulvin
The European Physical Journal Special Topics
(2017)
226
837
(doi: 10.1140/epjst/e2016-60358-y)
Emerging approaches to stabilise photocorrodible electrodes and catalysts for solar fuel applications
Energy & Environmental Science
(2017)
10
1115
(doi: 10.1039/C7EE00777A)
Frontispiz: Ein achtkerniger metallosupramolekularer Würfel mit Spin‐Crossover‐Eigenschaften
Angewandte Chemie
(2017)
129
ange.201781861
(doi: 10.1002/ange.201781861)
Frontispiece: An Octanuclear Metallosupramolecular Cage Designed To Exhibit Spin‐Crossover Behavior
Angewandte Chemie International Edition
(2017)
56
anie.201781861
(doi: 10.1002/anie.201781861)
Photoelectrochemical Oxygen Evolution Reaction Activity of Amorphous Co-La Double Hydroxide-BiVO4 Fabricated by Pulse Plating Electrodeposition
ACS Energy Letters
(2017)
2
1062
Fine Tuning Classical and Quantum Molecular Dynamics using a Generalized Langevin Equation
(2017)