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- Currently displaying 1721 - 1740 of 29283 publications
Exploring the parameter space of an endohedral atom in a cylindrical cavity
The Journal of chemical physics
(2023)
159
164308
(doi: 10.1063/5.0170010)
Machine Learning Nucleation Collective Variables with Graph Neural Networks
Journal of chemical theory and computation
(2023)
20
1600
(doi: 10.1021/acs.jctc.3c00722)
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)
De novo design of knotted tandem repeat proteins
Nature communications
(2023)
14
6746
(doi: 10.1038/s41467-023-42388-y)
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)
Exploiting the Catenane Mechanical Bond Effect for Selective Halide Anion Transmembrane Transport.
Angewandte Chemie (International ed. in English)
(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)
An automated single-molecule FRET platform for high-content, multiwell plate screening of biomolecular conformations and dynamics
Nature communications
(2023)
14
6511
(doi: 10.1038/s41467-023-42232-3)
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)
Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4
J Am Chem Soc
(2023)
145
23739
(doi: 10.1021/jacs.3c08232)
High-performance electrochromic supercapacitor based on polyoxotitanates/conjugated polymer hybrid films for visualization for the energy status
Journal of Power Sources
(2023)
581
233490
Identification of phase separating proteins associated with human disease
Nature Reviews Molecular Cell Biology
(2023)
25
5
(doi: 10.1038/s41580-023-00672-1)
Does Heat Play a Role in the Observed Behavior of Aqueous Photobatteries?
ACS Energy Letters
(2023)
8
4625
Impact of Molecular Weight on the Ionic and Electronic Transport of Self‐Doped Conjugated Polyelectrolytes Relevant to Organic Electrochemical Transistors
Advanced Functional Materials
(2023)
34
2310852
(doi: 10.1002/adfm.202310852)