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  • Currently displaying 4841 - 4860 of 30857 publications
Author(s)
Publication title
Journal Name
Publication year
Synthesis of a Diverse and Three-Dimensional Fragment Collection and The Development of a Novel Platform for Antibody Dual Functionalisation
AR Hanby
(2021)
Enantioselective synthesis of ammonium cations
MP Walsh, JM Phelps, ME Lennon, DS Yufit, MO Kitching
Nature
(2021)
597
Kinetics of Disordered Proteins and their Interactions
T Lohr
(2021)
The Independent Volcanic Eruption Source Parameter Archive (IVESPA, version 1.0): A new observational database to support explosive eruptive column model validation and development
TJ Aubry, S Engwell, C Bonadonna, G Carazzo, S Scollo, AR Van Eaton, IA Taylor, D Jessop, J Eychenne, M Gouhier, LG Mastin, KL Wallace, S Biass, M Bursik, RG Grainger, AM Jellinek, A Schmidt
Journal of Volcanology and Geothermal Research
(2021)
417
Use of chemical informatics, quantum chemistry modelling and artificial intelligence algorithms to predict molecular initiating events
TEH Allen, AJ Wedlake, MN Grayson, AM Middleton, M Folia, M Baltazar, P Piechota, E Gelžinytė, JM Goodman, PJ Russell, P Kukic, S Gutsell
Toxicology Letters
(2021)
350
A transcriptomics-based new approach methodology (NAM) identifies points of departure (PoDs) of adaptive stress in HepG2 cells
D Basili, B Chambers, M Liddell, J Houghton, A White, I Shah, A Middleton, A Bender
TOXICOLOGY LETTERS
(2021)
350
Small Molecule Approaches Towards Targeted RNA degradation
S Mikutis
(2021)
Use of chemical informatics, quantum chemistry modelling and artificial intelligence algorithms to predict molecular initiating events
TEH Allen, AJ Wedlake, MN Grayson, AM Middleton, M Folia, M Baltazar, P Piechota, E Gelzinyte, JM Goodman, PJ Russell, P Kukic, S Gutsell
TOXICOLOGY LETTERS
(2021)
350
Relating early cellular events to Drug-Induced Liver Injury (DILI) using time-resolved transcriptomic and histopathology data
A Liu, N Han, J Munoz-Muriedas, A Bender
Toxicology Letters
(2021)
350
The impact of pooling animal histopathology control data on the statistical detection of treatment-related findings
PSR Wright, KA Briggs, R Thomas, GF Smith, G Maglennon, P Mikulskis, M Chapman, N Greene, A Bender
Toxicology Letters
(2021)
350
Data-Driven Research for Amorphous Materials: Towards Seamless Utilization of Publication Data in Chemical Sciences
J Mavracic
(2021)
Anaerobic, NADH-Dependent Haem Breakdown in a Family of Haemoproteins
AD Keith
(2021)
Modelling the macroeconomics of a 'closing the green finance gap' scenario for an energy transition
S Hafner, A Jones, A Anger-Kraavi, I Monasterolo
Environmental Innovation and Societal Transitions
(2021)
40
Spin-Pure Stochastic-CASSCF via GUGA-FCIQMC Applied to Iron-Sulfur Clusters.
W Dobrautz, O Weser, NA Bogdanov, A Alavi, G Li Manni
Journal of Chemical Theory and Computation
(2021)
17
optimade-python-tools: a Python library for serving and consuming materials data via OPTIMADE APIs
M Evans, C Andersen, S Dwaraknath, M Scheidgen, Á Fekete, D Winston
The Journal of Open Source Software
(2021)
6
Thermodynamic Characterisation of Amyloid Fibrils
KL Callaghan
(2021)
Cell morphology descriptors and gene ontology profiles improve prediction for mitochondrial toxicity
S Seal, MA Trapotsi, JC Puigvert, H Yang, O Spjuth, A Bender
Toxicology Letters
(2021)
350
Nonhuman IAPP Variants Inhibit Human IAPP Aggregation.
A Oakes, K Menefee, A Lamba, LM Palato, DJ Rinauro, A Tun, B Jauregui, K Chang, LA Nogaj, DA Moffet
Protein & Peptide Letters
(2021)
28
Artificial Intelligence in Drug Discovery and Computational Safety: What is Realistic, What are Illusions?
A Bender
TOXICOLOGY LETTERS
(2021)
350
Prediction of inotropic effect based on calcium transients in human iPSC-derived cardiomyocytes using novel waveform parameters and a modified random forest algorithm
H Yang, O Obrezanova, A Pointon, W Stebbeds, J Francis, KA Beattie, P Clements, JS Harvey, GF Smith, A Bender
TOXICOLOGY LETTERS
(2021)
350