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- Currently displaying 5221 - 5240 of 31556 publications
Use of chemical informatics, quantum chemistry modelling and artificial intelligence algorithms to predict molecular initiating events
Toxicology Letters
(2021)
350
S17
Modelling the macroeconomics of a ‘closing the green finance gap’ scenario for an energy transition
Environmental Innovation and Societal Transitions
(2021)
40
536
(doi: 10.1016/j.eist.2021.10.006)
Artificial Intelligence in Drug Discovery and Computational Safety: What is Realistic, What are Illusions?
TOXICOLOGY LETTERS
(2021)
350
S49
A transcriptomics-based new approach methodology (NAM) identifies points of departure (PoDs) of adaptive stress in HepG2 cells
TOXICOLOGY LETTERS
(2021)
350
S216
The Independent Volcanic Eruption Source Parameter Archive (IVESPA, version 1.0): A new observational database to support explosive eruptive column model validation and development
Journal of Volcanology and Geothermal Research
(2021)
417
107295
Anaerobic, NADH-Dependent Haem Breakdown in a Family of Haemoproteins
(2021)
(doi: 10.17863/CAM.80344)
Modulating Chalcogen Bonding and Halogen Bonding Sigma-Hole Donor Atom Potency and Selectivity for Halide Anion Recognition.
Angewandte Chemie (International ed. in English)
(2021)
60
21973
(doi: 10.1002/anie.202108591)
Thermodynamics and kinetics of crystallisation in deeply supercooled Stillinger-Weber silicon
(2021)
(doi: 10.48550/arxiv.2108.13749)
Visible light photocatalysts from low-grade iron ore; the environmentally benign production of magnetite/carbon (Fe3O4/C) nanocomposites
Environmental Science and Pollution Research
(2021)
29
6698
(doi: 10.1007/s11356-021-15972-2)
The Amyloid-β Pathway in Alzheimer’s Disease
Mol Psychiatry
(2021)
26
5481
(doi: 10.1038/s41380-021-01249-0)
Evaluating the performance of a clinical genome sequencing program for diagnosis of rare genetic disease, seen through the lens of craniosynostosis.
Genetics in medicine : official journal of the American College of Medical Genetics
(2021)
23
2360
(doi: 10.1038/s41436-021-01297-5)
Antibonding-Induced Anomalous Temperature Dependence of the Band Gap in Crystalline Ge2Sb2Te5
Journal of Physical Chemistry C
(2021)
125
19537
(doi: 10.1021/acs.jpcc.1c05342)
Wet deposition in the remote western and central Mediterranean as a source of trace metals to surface seawater
(2021)
(doi: 10.5194/acp-2021-624)
Supplementary material to "Wet deposition in the remote western and central Mediterranean as a source of trace metals to surface seawater"
(2021)
Automated and Continuous-Flow Platform to Analyze Semiconductor–Metal Complex Hybrid Systems for Photocatalytic CO2 Reduction
ACS Catalysis
(2021)
11
11266
(doi: 10.1021/acscatal.1c02921)
Predicting polarizabilities of silicon clusters using local chemical environments
(2021)
(doi: 10.48550/arxiv.2101.03854)
High-Throughput Selection and Characterisation of Aptamers on Optical Next-Generation Sequencers
International journal of molecular sciences
(2021)
22
9202
(doi: 10.3390/ijms22179202)