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- Currently displaying 4461 - 4480 of 30304 publications
Relating early cellular events to Drug-Induced Liver Injury (DILI) using time-resolved transcriptomic and histopathology data
Toxicology Letters
(2021)
350
S124
Prediction of inotropic effect based on calcium transients in human iPSC-derived cardiomyocytes using novel waveform parameters and a modified random forest algorithm
TOXICOLOGY LETTERS
(2021)
350
S61
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)
optimade-python-tools: a Python library for serving and consuming materials data via OPTIMADE APIs
The Journal of Open Source Software
(2021)
6
3458
(doi: 10.21105/joss.03458)
The impact of pooling animal histopathology control data on the statistical detection of treatment-related findings
Toxicology Letters
(2021)
350
s63
Use of chemical informatics, quantum chemistry modelling and artificial intelligence algorithms to predict molecular initiating events
TOXICOLOGY LETTERS
(2021)
350
S17
(doi: 10.17863/CAM.79048)
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
Cell morphology descriptors and gene ontology profiles improve prediction for mitochondrial toxicity
Toxicology Letters
(2021)
350
S81
Spin-Pure Stochastic-CASSCF via GUGA-FCIQMC Applied to Iron-Sulfur Clusters
J Chem Theory Comput
(2021)
17
5684
(doi: 10.1021/acs.jctc.1c00589)
Anaerobic, NADH-Dependent Haem Breakdown in a Family of Haemoproteins
(2021)
(doi: 10.17863/CAM.80344)
Data-Driven Research for Amorphous Materials: Towards Seamless Utilization of Publication Data in Chemical Sciences
(2021)
(doi: 10.17863/CAM.79174)
Use of chemical informatics, quantum chemistry modelling and artificial intelligence algorithms to predict molecular initiating events
Toxicology Letters
(2021)
350
S17
Thermodynamics and kinetics of crystallisation in deeply supercooled Stillinger-Weber silicon
(2021)
(doi: 10.48550/arxiv.2108.13749)
Modulating Chalcogen Bonding and Halogen Bonding Sigma-Hole Donor Atom Potency and Selectivity for Halide Anion Recognition.
Angewandte Chemie International Edition
(2021)
60
21973
(doi: 10.1002/anie.202108591)
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)
Cerebral Microdialysate Metabolite Monitoring using Mid-infrared Spectroscopy.
Anal Chem
(2021)
93
11929
(doi: 10.1021/acs.analchem.1c01149)