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- Currently displaying 4581 - 4600 of 30626 publications
Synergy conformal prediction applied to large-scale bioactivity datasets and in federated learning.
J Cheminform
(2021)
13
77
(doi: 10.1186/s13321-021-00555-7)
Interactions are important: Linking multi-physics mechanisms to the performance and degradation of solid-state batteries
Materials Today
(2021)
49
145
(doi: 10.1016/j.mattod.2021.02.011)
Dissection of the Polar and Non‐Polar Contributions to Aromatic Stacking Interactions in Solution
Angewandte Chemie
(2021)
133
24064
(doi: 10.1002/ange.202110809)
Identifizierung von reaktiven Zentren und Oberflächenfallen in Chalkopyrit‐Photokathoden
Angewandte Chemie
(2021)
133
23843
(doi: 10.1002/ange.202108994)
Applying Solid-state NMR Methods to the Study of Organic Shale Rocks
(2021)
(doi: 10.17863/CAM.81660)
Dissection of the Polar and Non‐Polar Contributions to Aromatic Stacking Interactions in Solution
Angewandte Chemie (International ed. in English)
(2021)
60
23871
(doi: 10.1002/anie.202110809)
Identifying Reactive Sites and Surface Traps in Chalcopyrite Photocathodes
Angew Chem Int Ed Engl
(2021)
60
23651
(doi: 10.1002/anie.202108994)
Electric field induced tuning of electronic correlation in weakly confining quantum dots
Physical Review B
(2021)
104
165401
(doi: 10.1103/physrevb.104.165401)
Interaction of Amyloid-β-(1-42) Peptide and Its Aggregates with Lipid/Water Interfaces Probed by Vibrational Sum-Frequency Generation Spectroscopy.
Journal of Physical Chemistry B
(2021)
125
11208
(doi: 10.1021/acs.jpcb.1c04882)
Halogen Bonding Heteroditopic Materials for Cooperative Sodium Iodide Binding and Extraction
Chemistry - A European Journal
(2021)
27
14600
(doi: 10.1002/chem.202102952)
Ab initio Study of Atomic Dynamics and Thermal Properties of Inorganic Clathrates, Chalcogenides and Perovskite Oxides
(2021)
(doi: 10.17863/CAM.102235)
Understanding the molecular bases of neurodegeneration: From the structural characterisation of the aggregates to the establishment of an iPSC-derived neuronal model
(2021)
(doi: 10.17863/CAM.89070)
N'-(Pyridin-3-ylmethylene)benzenesulfonohydrazide: Crystal structure, DFT, Hirshfeld surface and in silico anticancer studies
European Journal of Chemistry
(2021)
12
256
Eruptive style controls the formation of silicon hexafluoride salts on volcanic ash: The case of the 2010 eruption of Eyjafjallajo spacing diaeresis kull volcano, Iceland
Chemical Geology
(2021)
579
120327
Large area cellulose nanocrystal self-assembly: towards sustainable pigments
(2021)
(doi: 10.17863/CAM.87956)
F-Divergences and Cost Function Locality in Generative Modelling with Quantum Circuits.
Entropy (Basel)
(2021)
23
1281
(doi: 10.3390/e23101281)
Ab initio Study of Atomic Dynamics and Thermal Properties of Inorganic Clathrates, Chalcogenides and Perovskite Oxides (Redacted)
(2021)
Towards targeted post-translational modification of endogenous proteins in complex environments
(2021)
(doi: 10.17863/CAM.82590)
