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- Currently displaying 7701 - 7720 of 29364 publications
Selecting Chiral BINOL-Derived Phosphoric Acid Catalysts: General Model To Identify Steric Features Essential for Enantioselectivity
– Chemistry - A European Journal
(2017)
23,
14248
(doi: 10.1002/chem.201702019)
Role of surface defects in catalytic properties of CeO2 nanoparticles towards oxygen reduction reaction
– Materials Chemistry and Physics
(2017)
200,
99
Microscopic Marangoni flows cannot be predicted on the basis of pressure gradients
(2017)
(doi: 10.48550/arxiv.1710.00355)
Exploiting sparsity in free energy basin-hopping
– Chemical Physics Letters
(2017)
685,
288
(doi: 10.1016/j.cplett.2017.07.081)
Extending the lifetime of resonant atmospheric particulate mass sensors with solvent rinses
– IEEE Sensors Letters
(2017)
1,
1
(doi: 10.1109/LSENS.2017.2734569)
Harnessing Surface-Functionalized Metal–Organic Frameworks for Selective Tumor Cell Capture
– Chemistry of Materials
(2017)
29,
8052
The Significance of the Amorphous Potential Energy Landscape for Dictating Glassy Dynamics and Driving Solid-State Crystallisation
(2017)
(doi: 10.26434/chemrxiv.5328235.v2)
Communication: Truncated non-bonded potentials can yield unphysical behavior in molecular dynamics simulations of interfaces.
– J Chem Phys
(2017)
147,
121102
(doi: 10.1063/1.4997698)
Molecular simulation study of CO2 and N2 absorption in a phosphonium based organic ionic plastic crystal.
– J Chem Phys
(2017)
147,
124703
(doi: 10.1063/1.4993654)
Stochastic coupled cluster theory: Efficient sampling of the coupled cluster expansion
– J Chem Phys
(2017)
147,
124105
(doi: 10.1063/1.4991795)
Buildup of Redox-Responsive Hybrid from Polyoxometalate and Redox-Active Conducting Oligomer: Its Self-Assemblies with Controllable Morphologies.
– Chemistry (Weinheim an der Bergstrasse, Germany)
(2017)
23,
14860
(doi: 10.1002/chem.201702857)
X-ray diffraction analysis of cubic zincblende III-nitrides
– Journal of Physics D
(2017)
50,
433002
(doi: 10.1088/1361-6463/aa865e)
Target identification of $\textit{Mycobacterium tuberculosis phenotypic}$ hits using a concerted chemogenomic, biophysical and structural approach
– Frontiers in Pharmacology
(2017)
8,
681
(doi: 10.3389/fphar.2017.00681)
Kinetic constraints on self-assembly into closed supramolecular structures.
– Scientific reports
(2017)
7,
12295
(doi: 10.1038/s41598-017-12528-8)
Machine learning techniques for improving prediction of unplanned intensive care readmission
(2017)
What makes a good descriptor for heterogeneous ice nucleation on OH-patterned surfaces
– Physical Review B
(2017)
96,
115441
(doi: 10.1103/physrevb.96.115441)
Interfacial structure and structural forces in mixtures of ionic liquid with a polar solvent.
– Faraday Discussions
(2017)
206,
427
(doi: 10.1039/c7fd00168a)
Role of Salt, Pressure, and Water Activity on Homogeneous Ice Nucleation
– J Phys Chem Lett
(2017)
8,
4486
(doi: 10.1021/acs.jpclett.7b01551)