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- Currently displaying 6161 - 6180 of 29636 publications
Transforming the Accuracy and Numerical Stability of ReaxFF Reactive Force Fields
J Phys Chem Lett
(2019)
10
7215
(doi: 10.1021/acs.jpclett.9b02810)
Fragment-Based Design of Mycobacterium Tuberculosis InhA Inhibitors
(2019)
Correction to: 4-Repeat tau seeds and templating subtypes as brain and CSF biomarkers of frontotemporal lobar degeneration.
Acta Neuropathologica
(2019)
139
79
(doi: 10.1007/s00401-019-02092-y)
Resolving Anharmonic Lattice Dynamics in Molecular Crystals With X-Ray Diffraction and Terahertz Spectroscopy
(2019)
(doi: 10.26434/chemrxiv.10277783)
A Simple Molecular Design Strategy for Delayed Fluorescence toward 1000 nm
Journal of the American Chemical Society
(2019)
141
18390
(doi: 10.1021/jacs.9b09323)
Spatially Resolving Anharmonic Lattice Dynamics in Molecular Crystals With X-Ray Diffraction and Terahertz Spectroscopy
(2019)
Structural Basis for the Allosteric Regulation of the SbtA Bicarbonate Transporter by the PII-like Protein, SbtB, from Cyanobium sp. PCC7001.
Biochemistry
(2019)
58
5030
(doi: 10.1021/acs.biochem.9b00880)
Host-Guest Chemistry Meets Electrocatalysis: Cucurbit[6]uril on a Au Surface as a Hybrid System in CO2 Reduction.
ACS Catal
(2019)
10
751
(doi: 10.1021/acscatal.9b04221)
Automated Fitting of Neural Network Potentials at Coupled Cluster Accuracy: Protonated Water Clusters as Testing Ground
Journal of chemical theory and computation
(2019)
16
88
(doi: 10.1021/acs.jctc.9b00805)
Chemoenzymatic Total Synthesis of Sorbicatechol Structural Analogues and Evaluation of Their Antiviral Potential
Chembiochem
(2019)
21
492
(doi: 10.1002/cbic.201900472)
Supersaturated proteins are enriched at synapses and underlie cell and tissue vulnerability in Alzheimer's disease
Heliyon
(2019)
5
e02589
A Unified Total Synthesis of the Actinoallolides, a Family of Potent Anti-trypanosomal Macrolides
Angewandte Chemie (International ed. in English)
(2019)
59
1572
(doi: 10.1002/anie.201914042)
Structural Color of Colloidal Clusters as a Tool to Investigate Structure and Dynamics
Advanced Functional Materials
(2019)
30
1907730
(doi: 10.1002/adfm.201907730)
Label-Free Analysis of Protein Aggregation and Phase Behavior.
ACS Nano
(2019)
13
13940
(doi: 10.1021/acsnano.9b05552)
AhR Agonist Activity Confirmation of Polyhalogenated Carbazoles (PHCZs) Using an Integration of in Vitro, in Vivo, and in Silico Models
Environmental science & technology
(2019)
53
14716
(doi: 10.1021/acs.est.9b05388)
Novel Small Molecules Targeting the Intrinsically Disordered Structural Ensemble of α-Synuclein Protect Against Diverse α-Synuclein Mediated Dysfunctions
Scientific Reports
(2019)
9
16947
(doi: 10.1038/s41598-019-52598-4)
Selective Separation of Polyaromatic Hydrocarbons by Phase Transfer of Coordination Cages
Journal of the American Chemical Society
(2019)
141
18949
(doi: 10.1021/jacs.9b10741)
GLP-1R is downregulated in beta cells of NOD mice and T1D patients
(2019)
845776
(doi: 10.1101/845776)
Structural transitions in the RNA 7SK 5' hairpin and their effect on HEXIM binding.
Nucleic acids research
(2019)
48
373
(doi: 10.1093/nar/gkz1071)
Dissolved carbon monoxide concentration monitoring platform based on direct electrical connection of CO dehydrogenase with electrically accessible surface structure.
Bioresource technology
(2019)
297
122436