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- Currently displaying 4681 - 4700 of 30660 publications
On the "Matsubara heating" of overtone intensities and Fermi splittings
J Chem Phys
(2021)
155
104107
(doi: 10.1063/5.0056829)
Lanthanide-based single-molecule magnets: A rational design by chemical intuition
(2021)
(doi: 10.17863/CAM.85023)
Mechanical adaptation of brachiopod shells via hydration-induced structural changes.
Nat Commun
(2021)
12
5383
(doi: 10.1038/s41467-021-25613-4)
Myths of high-throughput experimentation and automation in chemistry
Chem
(2021)
7
2259
(doi: 10.1016/j.chempr.2021.08.012)
In silico approaches in organ toxicity hazard assessment: Current status and future needs in predicting liver toxicity
Computational Toxicology
(2021)
20
100187
(doi: 10.1016/j.comtox.2021.100187)
The Influence of Chemical and Mineral Compositions on the Parameterization of Immersion Freezing by Volcanic Ash Particles
Journal of Geophysical Research Atmospheres
(2021)
126
e2020JD033356
(doi: 10.1029/2020JD033356)
Impacts of Hydroperoxymethyl Thioformate on the Global Marine Sulfur Budget
ACS Earth and Space Chemistry
(2021)
5
2577
Visible light-mediated radical fluoromethylation: Via halogen atom transfer activation of fluoroiodomethane
Chem Sci
(2021)
12
12812
(doi: 10.1039/d1sc04554g)
Understanding the interaction of organic corrosion inhibitors with copper at the molecular scale: Benzotriazole on Cu(110)
Applied Surface Science
(2021)
570
151206
(doi: 10.1016/j.apsusc.2021.151206)
Minimal Design Principles for Icosahedral Virus Capsids
ACS Nano
(2021)
15
14873
(doi: 10.1021/acsnano.1c04952)
Truce-Smiles Rearrangements by Strain Release: Harnessing Primary Alkyl Radicals for Metal-Free Arylation
Angewandte Chemie International Edition
(2021)
60
22219
(doi: 10.1002/anie.202108240)
Inhibition of Class A β-Lactamase (TEM-1) by Narrow Fractions of Humic Substances
ACS omega
(2021)
6
23873
(doi: 10.1021/acsomega.1c02841)
Overcoming Metastable CO2Adsorption in a Bulky Diamine-Appended Metal-Organic Framework
J Am Chem Soc
(2021)
143
15258
(doi: 10.1021/jacs.1c06434)
New Frontiers for Machine Learning in Protein Science
Journal of molecular biology
(2021)
433
167232
(doi: 10.1016/j.jmb.2021.167232)
Aggregation condition–structure relationship of mouse prion protein fibrils
International journal of molecular sciences
(2021)
22
9635
(doi: 10.3390/ijms22179635)
Halogen-Bonding Strapped Porphyrin BODIPY Rotaxanes for Dual Optical and Electrochemical Anion Sensing.
Chemistry – A European Journal
(2021)
27
14550
(doi: 10.1002/chem.202102493)
Iron(II)‐Catalyzed Aerobic Biomimetic Oxidation of N‐Heterocycles
Chemistry (Weinheim an der Bergstrasse, Germany)
(2021)
27
13725
(doi: 10.1002/chem.202102483)
Single-route delaminated clay composites for efficient visible-light photo-mineralization of antibiotic-resistant bacteria and associated genes in water
Applied Catalysis B Environment and Energy
(2021)
292
120143
(doi: 10.1016/j.apcatb.2021.120143)
Protein Structure Prediction Using a Maximum Likelihood Formulation of a Recurrent Geometric Network
(2021)
2021.09.03.458873
(doi: 10.1101/2021.09.03.458873)