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- Currently displaying 1281 - 1300 of 29385 publications
Exploring the parameter space of an endohedral atom in a cylindrical cavity
– Journal of Chemical Physics
(2023)
159,
164308
(doi: 10.1063/5.0170010)
Molecular Dynamics: Investigating the Self-Association of Stearic Acid and Heteroassociation of Stearic Acid-Water in Cyclohexane.
– ACS Omega
(2023)
8,
41100
(doi: 10.1021/acsomega.3c03473)
Catalytic, asymmetric carbon-nitrogen bond formation using metal nitrenoids: from metal-ligand complexes via metalloporphyrins to enzymes.
– Chemical science
(2023)
14,
12447
(doi: 10.1039/d3sc04661c)
Replication of synthetic recognition-encoded oligomers by ligation of trimer building blocks
– Organic Chemistry Frontiers
(2023)
10,
5950
(doi: 10.1039/d3qo01717f)
De novo design of knotted tandem repeat proteins.
– Nat Commun
(2023)
14,
6746
(doi: 10.1038/s41467-023-42388-y)
Microfluidic antibody profiling after repeated SARS-CoV-2 vaccination links antibody affinity and concentration to impaired immunity and variant escape in patients on anti-CD-20 therapy
(2023)
(doi: 10.1101/2023.10.22.563481)
Molecular mechanism of α-synuclein aggregation on lipid membranes revealed
(2023)
(doi: 10.1101/2023.10.20.563279)
ACEpotentials.jl: A Julia Implementation of the Atomic Cluster Expansion
– Journal of Chemical Physics
(2023)
159,
164101
(doi: 10.1063/5.0158783)
Thesis Access Confirmation Form
(2023)
Reaction dynamics as the missing puzzle piece: the origin of selectivity in oxazaborolidinium ion-catalysed reactions
– Chem Sci
(2023)
14,
12355
(doi: 10.1039/d3sc03009a)
Red-light modulated ortho-chloro azobenzene photoswitch for peptide stapling via aromatic substitution.
– Rsc Chemical Biology
(2023)
5,
49
(doi: 10.1039/d3cb00176h)
Exploiting the Catenane Mechanical Bond Effect for Selective Halide Anion Transmembrane Transport.
– Angewandte Chemie International Edition
(2023)
62,
e202312745
(doi: 10.1002/anie.202312745)
Insights into Drug Cardiotoxicity from Biological and Chemical Data: The First Public Classifiers for FDA DICTrank.
(2023)
(doi: 10.1101/2023.10.15.562398)
Scientific Machine Learning of 2D Perovskite Nanosheet Formation.
– J Am Chem Soc
(2023)
145,
23076
(doi: 10.1021/jacs.3c05984)
Importance of electronic correlations in exploring the exotic phase diagram of layered LixMnO2
– Physical Review B
(2023)
108,
165124
(doi: 10.1103/physrevb.108.165124)
Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4
– J Am Chem Soc
(2023)
145,
23739
(doi: 10.1021/jacs.3c08232)
Morphology-Dependent Investigation of Li-ion Insertion into Single Crystal Hematite α‑Fe2O3 Nanostructures
– The Journal of Physical Chemistry C
(2023)
127,
20608
(doi: 10.1021/acs.jpcc.3c04966)
An automated single-molecule FRET platform for high-content, multiwell plate screening of biomolecular conformations and dynamics
– Nat Commun
(2023)
14,
6511
(doi: 10.1038/s41467-023-42232-3)
High-performance electrochromic supercapacitor based on polyoxotitanates/conjugated polymer hybrid films for visualization for the energy status
– Journal of Power Sources
(2023)
581,
233490