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- Currently displaying 3221 - 3240 of 30704 publications
Sequence-based prediction of pH-dependent protein solubility using CamSol
Briefings in bioinformatics
(2023)
24
bbad004
(doi: 10.1093/bib/bbad004)
Understanding surface reactivity, local structure, and lithium-metal dendrite initiation in garnet solid electrolytes
(2023)
(doi: 10.17863/CAM.100640)
Accelerated Chemical Reaction Optimization using Multi-Task Learning
(2023)
(doi: 10.26434/chemrxiv-2023-stqrt)
Development, intercomparison and evaluation of an improved mechanism for the oxidation of dimethyl sulfide in the UKCA model
(2023)
(doi: 10.5194/acp-2023-42)
Silver nanostructure-modified graphite electrode for in-operando SERRS investigation of iron porphyrins during high-potential electrocatalysis.
J Chem Phys
(2023)
158
044201
(doi: 10.1063/5.0136333)
Nanosecond dynamics of solitons in confined Bose-Einstein condensates
(2023)
(doi: 10.26434/chemrxiv-2023-8k3sq)
Supplementary material to "Development, intercomparison and evaluation of an improved mechanism for the oxidation of dimethyl sulfide in the UKCA model"
(2023)
Versatile Biosynthetic Approach to Regioselective Enzyme Patterning for Direct Bioelectrocatalysis Application
Advanced Materials Technologies
(2023)
8
2201324
(doi: 10.1002/admt.202201324)
Tracking and Understanding Dynamics of Atoms and Clusters of Late Transition Metals with In-Situ DRIFT and XAS Spectroscopy Assisted by DFT
The Journal of Physical Chemistry C
(2023)
127
3032
(doi: 10.1021/acs.jpcc.2c07263)
Excited states, symmetry breaking, and unphysical solutions in state-specific CASSCF theory
(2023)
(doi: 10.48550/arxiv.2301.11731)
A Deep Potential model for liquid-vapor equilibrium and cavitation rates of water
(2023)
Furan-based Thiamine Antagonists for Pyruvate Dehydrogenase: SAR Investigation, Biochemical Evaluation and Computational Analysis
Organic & biomolecular chemistry
(2023)
21
1755
(doi: 10.1039/d2ob02272a)
Cation disorder dominates the defect chemistry of high-voltage LiMn1.5Ni0.5O4 (LMNO) spinel cathodes
(2023)
Hallucinating functional protein sequences.
Nature biotechnology
(2023)
41
1073
(doi: 10.1038/s41587-022-01634-2)
Correction: Thiamine analogues as inhibitors of pyruvate dehydrogenase and discovery of a thiamine analogue with non-thiamine related antiplasmodial activity.
Rsc Medicinal Chemistry
(2023)
14
190
(doi: 10.17863/CAM.91768)
Convergence of Møller-Plesset perturbation theory for excited reference states
(2023)
(doi: 10.48550/arxiv.2301.10539)
Roadmap on chalcogenide photonics
Journal of Physics Photonics
(2023)
5
012501
(doi: 10.1088/2515-7647/ac9a91)
Chem-map profiles drug binding to chromatin in cells.
Nature biotechnology
(2023)
41
1265
(doi: 10.1038/s41587-022-01636-0)