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- Currently displaying 1 - 20 of 29968 publications
DP5 without DFT: Uncertainty-calibrated graph neural net accelerates structure confirmation via NMR
Chemical Science
(2026)
(doi: 10.1039/D5SC06988B)
Chemical Softness as a Predictor for Reactivity at Metal Surfaces
Physical Chemistry Chemical Physics
(2026)
(doi: 10.1039/D5CP03378K)
Charge-triggered switching mechanism in selenium selector enabling ultralow leakage current.
Nature materials
(2026)
(doi: 10.1038/s41563-026-02499-5)
A Computational Community Blind Challenge on Pan-Coronavirus Drug Discovery Data
Journal of chemical information and modeling
(2026)
acs.jcim.5c02106
(doi: 10.1021/acs.jcim.5c02106)
Condensate-Driven Transcriptional Reprogramming Defines Core Vulnerabilities in Esophageal and Gastric Cancers
(2026)
(doi: 10.64898/2026.02.23.707358)
Electrostatic control of chromatin compaction safeguards against apoptotic DNA release
(2026)
(doi: 10.64898/2026.02.23.707452)
Highly mutagenic continuous evolution in E. coli using a Φ29-based orthogonal replication system
Nat Biotechnol
(2026)
1
(doi: 10.1038/s41587-025-02944-x)
Exploiting the path-integral radius of gyration in open quantum dynamics.
The Journal of Chemical Physics
(2026)
164
084113
(doi: 10.1063/5.0314385)
Development of Fully Interactive Hydrogen with Methane in UKESM1.0
Geoscientific Model Development
(2026)
19
1537
(doi: 10.5194/gmd-19-1537-2026)
Stereoselective additions to alkenylphosphonium salts for the synthesis of P-stereogenic compounds
Chemical Science
(2026)
(doi: 10.1039/D5SC09946C)
Stereoselective additions to alkenylphosphonium salts for the synthesis of P-stereogenic compounds
Chem Sci
(2026)
(doi: 10.1039/d5sc09946c)
Defect-Limited Efficiency of Pnictogen Chalcohalide Solar Cells
Chemistry of Materials
(2026)
acs.chemmater.5c03275
Exploring Size-Controlled Exciton Evolution Using DNA Libraries.
J Am Chem Soc
(2026)
jacs.5c21113
(doi: 10.1021/jacs.5c21113)
A Goldilocks zone of DNA flexibility defines stable yet plastic nucleosomes, tuned by histone chemistry
(2026)
(doi: 10.64898/2026.02.16.706184)
A universal phase-plane model for in vivo protein aggregation.
The Journal of Chemical Physics
(2026)
164
075101
(doi: 10.1063/5.0312752)
Nanoscopic tau aggregates are not shared intermediates but disease-specific entities across tauopathies
Cell Reports
(2026)
45
116934
(doi: 10.1016/j.celrep.2026.116934)
Structural defects in amyloid-β fibrils drive secondary nucleation.
Nature communications
(2026)
17
1933
(doi: 10.1038/s41467-026-69377-1)
Cell-Level Model to Predict the Spatiotemporal Dynamics of Neurodegenerative Disease
PRX Life
(2026)
4
013021
(doi: 10.1103/f9hz-xvpr)
Macrocyclic Covalent Encapsulation of a Multi-Resonant Emitter: Understanding and Controlling Interactions in Highly Efficient Deep-Blue OLEDs.
Journal of the American Chemical Society
(2026)
jacs.5c16290
(doi: 10.1021/jacs.5c16290)