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- Currently displaying 6461 - 6480 of 31156 publications
Improving double-ended transition state searches for soft-matter systems.
J Chem Phys
(2020)
153
034104
(doi: 10.1063/5.0011829)
An accurate and transferable machine learning potential for carbon
Journal of Chemical Physics
(2020)
153
034702
(doi: 10.1063/5.0005084)
Genome-wide DNA Methylation Signatures Are Determined by DNMT3A/B Sequence Preferences
Biochemistry
(2020)
59
2541
(doi: 10.1021/acs.biochem.0c00339)
Hydrothermal polymerization towards fully biobased polyazomethines
Chemical communications (Cambridge, England)
(2020)
56
9194
(doi: 10.1039/d0cc03026k)
Real-Time Highly-Sensitive Protein Quantification Through On-Chip Chemiluminescence
(2020)
Nanoporous Silica Preconcentrator for Vapor-Phase DMNB, a Detection Taggant for Explosives
ACS omega
(2020)
5
18073
(doi: 10.1021/acsomega.0c01615)
Applying support-vector machine learning algorithms toward predicting host-guest interactions with cucurbit[7]uril
Phys Chem Chem Phys
(2020)
22
14976
(doi: 10.1039/c9cp05800a)
Efficient and exact sampling of transition path ensembles on Markovian networks
Journal of Chemical Physics
(2020)
153
024121
(doi: 10.1063/5.0012128)
Quantitative Supramolecular Heterodimerization for Efficient Energy Transfer
Angewandte Chemie
(2020)
132
16097
(doi: 10.1002/ange.202006530)
Quantitative Supramolecular Heterodimerization for Efficient Energy Transfer.
Angewandte Chemie (International ed. in English)
(2020)
59
15963
(doi: 10.1002/anie.202006530)
A well-behaved theoretical framework for ReaxFF reactive force fields
J Chem Phys
(2020)
153
021102
(doi: 10.1063/5.0013906)
Phonon traces in glassy vibrations
Physical Review B
(2020)
102
024202
(doi: 10.1103/PhysRevB.102.024202)
Emission State Structure and Linewidth Broadening Mechanisms in Type-II CdSe/CdTe Core-Crown Nanoplatelets: A Combined Theoretical-Single Nanocrystal Optical Study
Journal of Physical Chemistry C
(2020)
124
17352
(doi: 10.1021/acs.jpcc.0c04547)
Consequences of lipid remodeling of adipocyte membranes being functionally distinct from lipid storage in obesity
J Proteome Res
(2020)
19
3919
Highly Selective Asymmetric Hydrogenation of Oximes to Hydroxylamine Derivatives
Chem
(2020)
6
1517
(doi: 10.1016/j.chempr.2020.06.025)
Recent developments in the PySCF program package
Journal of Chemical Physics
(2020)
153
024109
(doi: 10.1063/5.0006074)
Insights into the synergistic mechanism of target resistance: A case study of N. lugens RDL-GABA receptors and fipronil
Biophys Chem
(2020)
265
106426
(doi: 10.1016/j.bpc.2020.106426)
Beyond Carbon: Enantioselective and Enantiospecific Reactions with Catalytically Generated Boryl- And Silylcopper Intermediates
ACS Cent Sci
(2020)
6
1070
(doi: 10.1021/acscentsci.0c00738)