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- Currently displaying 2341 - 2360 of 29854 publications
Accurate Energy Barriers for Catalytic Reaction Pathways: An Automatic Training Protocol for Machine Learning Force Fields
(2023)
(doi: 10.48550/arxiv.2301.09931)
Chem-map: Profiling drug binding to chromatin in cells
Nature Biotechnology
(2023)
41
1265
(doi: 10.1038/s41587-022-01636-0)
Cooperative Initiation in a Dinuclear Indium Complex for CO2 Epoxide Copolymerization.
Inorganic Chemistry
(2023)
62
1968
Disintegrate (DIN) Theory Enabling Precision Engineering of Proteins.
ACS Cent Sci
(2023)
9
137
(doi: 10.1021/acscentsci.2c01455)
Roadmap on chalcogenide photonics
Journal of Physics: Photonics
(2023)
5
012501
(doi: 10.1088/2515-7647/ac9a91)
Soluble Diphenylhexatriene Dimers for Intramolecular Singlet Fission with High Triplet Energy
Journal of the American Chemical Society
(2023)
145
2499
(doi: 10.1021/jacs.2c12060)
Molecular Dynamics with Chemical Accuracy─Alkane Adsorption in Acidic Zeolites
ACS Catalysis
(2023)
13
2011
(doi: 10.1021/acscatal.2c05493)
Excess mortality associated with high ozone exposure: A national cohort study in China
Environmental science and ecotechnology
(2023)
15
100241
(doi: 10.1016/j.ese.2023.100241)
Multifaceted View on the Mechanism of a Photochemical Deracemization Reaction
J Am Chem Soc
(2023)
145
2354
(doi: 10.1021/jacs.2c11265)
AlphaFold Prediction of Structural Ensembles of Disordered Proteins
(2023)
(doi: 10.1101/2023.01.19.524720)
Hybrid photocathode based on a Ni molecular catalyst and Sb2Se3 for solar H2 production
Chemical communications (Cambridge, England)
(2023)
59
944
(doi: 10.17863/CAM.92435)
Bioprinting microporous functional living materials from protein-based core-shell microgels.
Nat Commun
(2023)
14
322
(doi: 10.1038/s41467-022-35140-5)
In situ Detection of Cobaloxime Intermediates During Photocatalysis Using Hollow-Core Photonic Crystal Fiber Microreactors
Angewandte Chemie (International ed. in English)
(2023)
62
e202214788
(doi: 10.1002/anie.202214788)
Spin-constrained Hartree-Fock and the generator coordinate method for the 2-site Hubbard model
(2023)
(doi: 10.48550/arxiv.2301.07865)
Multistate Redox-Switchable Ion Transport Using Chalcogen-Bonding Anionophores.
Journal of the American Chemical Society
(2023)
145
2661
(doi: 10.1021/jacs.2c12892)
Chemical bonds in collagen rupture selectively under tensile stress.
Physical Chemistry Chemical Physics
(2023)
25
2331
(doi: 10.1039/d2cp05051j)
Front Cover: Hybrid Androgen Receptor Inhibitors Outperform Enzalutamide and EPI‐001 in in vitro Models of Prostate Cancer Drug Resistance (ChemMedChem 2/2023)
ChemMedChem
(2023)
18
e202200703
(doi: 10.1002/cmdc.202200703)
In situ Detection of Cobaloxime Intermediates During Photocatalysis Using Hollow‐Core Photonic Crystal Fiber Microreactors
Angewandte Chemie
(2023)
135
e202214788
(doi: 10.1002/ange.202214788)
Review of the design considerations for the laboratory growth of sea ice
Journal of Glaciology
(2023)
69
953
(doi: 10.1017/jog.2022.115)
Variational graph encoders: a surprisingly effective generalist algorithm for holistic computer-aided drug design
(2023)
(doi: 10.1101/2023.01.11.523575)