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- Currently displaying 9301 - 9320 of 30639 publications
Exploiting sparsity in free energy basin-hopping
Chemical Physics Letters
(2017)
685
288
(doi: 10.1016/j.cplett.2017.07.081)
Disorder in convergent floral nanostructures enhances signalling to bees.
Nature
(2017)
550
469
(doi: 10.1038/nature24285)
High performance novel gadolinium doped ceria/yttria stabilized zirconia/nickel layered and hybrid thin film anodes for application in solid oxide fuel cells
Journal of Power Sources
(2017)
363
251
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)
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)
Molecular simulation study of CO2 and N2 absorption in a phosphonium based organic ionic plastic crystal.
The Journal of Chemical Physics
(2017)
147
124703
(doi: 10.1063/1.4993654)
Stochastic coupled cluster theory: Efficient sampling of the coupled cluster expansion.
The Journal of chemical physics
(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 – A European Journal
(2017)
23
14860
(doi: 10.1002/chem.201702857)
Analysis of Ribosome Stalling and Translation Elongation Dynamics by Deep Learning.
Cell Systems
(2017)
5
212
(doi: 10.1016/j.cels.2017.08.004)
X-ray diffraction analysis of cubic zincblende III-nitrides
Journal of Physics D Applied Physics
(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)
Pulling with the Pentafluorosulfanyl Acceptor in Push-Pull Dyes
The Journal of Organic Chemistry
(2017)
82
11008
(doi: 10.1021/acs.joc.7b01972)
Kinetic constraints on self-assembly into closed supramolecular structures.
Sci Rep
(2017)
7
12295
(doi: 10.1038/s41598-017-12528-8)
Machine learning techniques for improving prediction of unplanned intensive care readmission
(2017)
ESICM LIVES 2017 30th ESICM Annual Congress. September 23-27, 2017 Abstracts
Intensive care medicine experimental
(2017)
5
44
(doi: 10.1186/s40635-017-0151-4)
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)
Role of Salt, Pressure, and Water Activity on Homogeneous Ice Nucleation
The journal of physical chemistry letters
(2017)
8
4486
(doi: 10.1021/acs.jpclett.7b01551)
Interfacial structure and structural forces in mixtures of ionic liquid with a polar solvent.
Faraday discussions
(2017)
206
427
(doi: 10.1039/c7fd00168a)