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298

Statistically derived proxy potentials accelerate geometry optimisation of crystal structures

16 October 2023 by Dmytro Antypov and others at

University of Liverpool

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

A High Throughput Synthetic Workflow For Solid State Reactions

10 October 2023 by Christopher Hampson and others at

University of Liverpool

Inorganic Chemistry, Solid State Chemistry

A Systematic Study of Methyl Carbodithioate Esters as Effective Gold Contact Groups for Single-Molecule Electronics

10 October 2023 by Jonathan Ward and others at

Lancaster University

Materials Science, Nanoscience

Mechanical Manipulation of Quantum Interference in Single-Molecule Junctions

5 October 2023 by Amit Sil and others at

University of Liverpool

Physical Chemistry, Nanoscience

An Objective Improvement Approach to Solving Discounted Payoff Games

2 October 2023 by Daniele Dell'erba and others at

University of Liverpool

Data Structures and Algorithms

Handling of Past and Future with Phenesthe+

2 October 2023 by Manolis Pitsikalis and others at

University of Liverpool

Logic in Computer Science

Fine-tuning GPT-3 for machine learning electronic and functional properties of organic molecules

23 August 2023 by Zikai Xie and others at

University of Liverpool

Theoretical and Computational Chemistry, Artificial Intelligence

Not as simple as we thought: a rigorous examination of data aggregation in materials informatics

9 August 2023 by Federico Ottomano and others at

University of Liverpool

Materials Science

Identification of Unknown Inverted Singlet-Triplet Cores by High--Throughput Virtual Screening

19 July 2023 by Omer Omar and others at

University of Liverpool

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

Simple Axioms for Local Properties

11 July 2023 by Philippe Balbiani and others at

University of Liverpool

Logic in Computer Science

Microstructural model of Indacenodithiophene-co-benzothiadiazole Polymer: π-crossing interactions and their potential impact on charge transport

28 June 2023 by Hesam Makki and others at

University of Liverpool

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

Nuclear Magnetic Resonance Chemical Shift as Probe for Single-Molecule Charge Transport

26 June 2023 by Xiaohang Qiao and others at

University of Liverpool

Physical Chemistry, Nanoscience

Identification of New Inverted Singlet-Triplet Cores by High--Throughput Virtual Screening

25 May 2023 by Omer Omar and others at

University of Liverpool

Computational Chemistry and Modeling, Theory

The Ecology of Viruses in Urban Rodents with a Focus on SARS-CoV-2

23 May 2023 by Fisher, A. and others at

University of Liverpool

Ecology

The Liverpool Materials Discovery Server: A suite of computational tools for the collaborative discovery of materials

18 May 2023 by Samantha Durdy and others at

University of Liverpool

Materials Science, Artificial Intelligence

Floral presence and flower identity alter cereal aphid endosymbiont communities on adjacent crops

11 May 2023 by Zytynska, E. and others at

University of Liverpool

Ecology

Socioeconomic position and the influence of food portion size on daily energy intake in adult females: two randomized control trials

27 April 2023 by Langfield, T. and others at

University of Liverpool

Nutrition

From monomer sequence to charge mobility in semiconductor polymers via model reduction

27 March 2023 by Suryoday Prodhan and others at

University of Liverpool

Theoretical and Computational Chemistry

History matters: thermal environment before, but not during wasp attack determines the efficiency of symbiont-mediated protection

22 March 2023 by Jones, E. and Hurst, G. at

University of Liverpool

Evolutionary Biology

Reinforcement Learning in Crystal Structure Prediction

21 March 2023 by Elena Zamaraeva and others at

University of Liverpool

Machine Learning, Materials Science

Segregation of pathways leading to pexophagy

21 February 2023 by Barone, G. and others at

University of Liverpool

Cell Biology

Activating words without language: Beta and theta oscillations reflect lexical access and control processes during verbal and non-verbal object recognition tasks

2 February 2023 by Branzi, F. and others at

University of Liverpool

Neuroscience

16 January 2023 by Tulloch, J. S. P. and others at

University of Liverpool

Public and Global Health

Competitive Aminal Formation during the Synthesis of a Highly Soluble, Isopropyl-Decorated Imine Porous Organic Cage

5 January 2023 by Rachel Kearsey and others at

University of Liverpool

Supramolecular Chemistry, Crystallography – Organic

The role of the γ subunit in the photosystem of the lowest-energy phototrophs

19 December 2022 by Namoon, D. and others at

University of Liverpool

Biochemistry

Evolutionary and cellular analysis of the dark pseudokinase PSKH2

15 December 2022 by Byrne, P. and others at

University of Liverpool

Biochemistry

Temporal Extracellular Vesicle Protein Changes following Intraarticular Treatment with Integrin α10β1-selected Mesenchymal Stem Cells in Equine Osteoarthritis

24 November 2022 by Clarke, J. and others at

University of Liverpool

Molecular Biology

Using deep learning predictions of inter-residue distances for model validation

9 November 2022 by Rodriguez, S. and others at

University of Liverpool

Bioinformatics

Fluorine-Rich Oxyfluoride Spinel Li1.25Ni0.625Mn1.125O3F Utilizing Redox-Active Ni and Mn for High Capacity and Improved Cyclability

18 October 2022 by Hong Cai and others at

University of Liverpool

Materials Chemistry, Energy Storage

Shining a Light on Photoresponsive Type III Porous Liquids

13 September 2022 by Michael Brand and others at

University of Liverpool

Materials Chemistry