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- Currently displaying 4001 - 4020 of 29607 publications
Submersed micropatterned structures control active nematic flow, topology, and concentration
Proceedings of the National Academy of Sciences of the United States of America
(2021)
118
e2106038118
(doi: 10.1073/pnas.2106038118)
An Empirical Model for Solvation Based on Surface Site Interaction Points
Chem Sci
(2021)
12
13193
(doi: 10.1039/d1sc03392a)
ChemDataExtractor 2.0: Autopopulated Ontologies for Materials Science.
J Chem Inf Model
(2021)
61
4280
(doi: 10.1021/acs.jcim.1c00446)
Lone pair driven anisotropy in antimony chalcogenide semiconductors
(2021)
(doi: 10.48550/arxiv.2109.08117)
Multi-stage ensemble-learning-based model fusion for surface ozone simulations: A focus on CMIP6 models.
Environmental Science and Ecotechnology
(2021)
8
100124
(doi: 10.1016/j.ese.2021.100124)
Photoredox-Catalyzed Dehydrogenative Csp3–Csp2 Cross-Coupling of Alkylarenes to Aldehydes in Flow
The Journal of Organic Chemistry
(2021)
86
13559
(doi: 10.1021/acs.joc.1c01621)
Liquid-liquid phase separation underpins the formation of replication factories in rotaviruses
The EMBO journal
(2021)
40
e107711
(doi: 10.15252/embj.2021107711)
Trapping or slowing the diffusion of T cell receptors at close contacts initiates T cell signaling
Proceedings of the National Academy of Sciences
(2021)
118
e2024250118
(doi: 10.1073/pnas.2024250118)
Efficient Quantum Vibrational Spectroscopy of Water with High-Order Path Integrals: From Bulk to Interfaces
Journal of Physical Chemistry Letters
(2021)
12
9108
(doi: 10.1021/acs.jpclett.1c02574)
Fcc vs. hcp competition in colloidal hard-sphere nucleation: on their relative stability, interfacial free energy and nucleation rate
Physical chemistry chemical physics : PCCP
(2021)
23
19611
(doi: 10.1039/d1cp01784e)
Microplastics and anthropogenic fibre concentrations in lakes reflect surrounding land use
PLoS Biol
(2021)
19
e3001389
(doi: 10.1371/journal.pbio.3001389)
Defect-Dependent Corrugation in Graphene.
Nano Letters
(2021)
21
8143
(doi: 10.1021/acs.nanolett.1c02585)
New Route to Battery Grade NaPF6 for Na-Ion Batteries: Expanding
the Accessible Concentration
Angewandte Chemie International Edition
(2021)
(doi: 10.1002/anie.202111215)
Deformable and Robust Core–Shell Protein Microcapsules Templated by Liquid–Liquid Phase‐Separated Microdroplets
Advanced Materials Interfaces
(2021)
8
2101071
(doi: 10.1002/admi.202101071)
Combating small-molecule aggregation with machine learning
Cell Reports Physical Science
(2021)
2
100573
(doi: 10.1016/j.xcrp.2021.100573)
Multicomponent alkene azidoarylation by anion-mediated dual catalysis
Nature
(2021)
598
597
(doi: 10.1038/s41586-021-03980-8)
Machine learning potentials for complex aqueous systems made simple
Proceedings of the National Academy of Sciences
(2021)
118
e2110077118
(doi: 10.1073/pnas.2110077118)
In silico approaches in organ toxicity hazard assessment: Current status and future needs for predicting heart, kidney and lung toxicities.
Computational Toxicology
(2021)
20
100188
(doi: 10.1016/j.comtox.2021.100188)
The binding of the small heat-shock protein αB-crystallin to fibrils of α-synuclein is driven by entropic forces
Proceedings of the National Academy of Sciences of the United States of America
(2021)
118
e2108790118
(doi: 10.1073/pnas.2108790118|1of8)