Dr David Palmer
Reader
Pure and Applied Chemistry
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Area of Expertise
- Theoretical and computational chemistry
- Solvation Thermodynamics
- Molecular Simulation
- Cheminformatics/Bioinformatics
- Drug Discovery
- Biochemistry
- Machine Learning
Prize And Awards
- Trustee
- Recipient
- 1/1/2016
- Chemical Structures Association Trust Grant
- Recipient
- 2/6/2014
- Marie Curie Intra-European Fellowship (FP7-PEOPLE-2010-IEF - 272391 - IETSOL)
- Recipient
- 1/2/2012
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Publications
- Rapid detection of heart failure using a spectroscopic liquid biopsy
- Christie Loren, Sala Alexandra, Cameron James M, Conn Justin JA, Palmer David S, McGeown William J, Cannon Jane A, Sharp John, Baker Matthew J
- Clinical Spectroscopy Vol 5 (2023)
- https://doi.org/10.1016/j.clispe.2023.100029
- Structure-guided design of a domain-selective bromodomain and extra terminal N-terminal bromodomain chemical probe
- Bradley Erin, Fusani Lucia, Chung Chun-wa, Craggs Peter D, Demont Emmanuel H, Humphreys Philip G, Mitchell Darren J, Phillipou Alexander, Rioja Inmaculada, Shah Rishi R, Wellaway Christopher R, Prinjha Rab K, Palmer David S, Kerr William J, Reid Marc, Wall Ian D, Cookson Rosa
- Journal of Medicinal Chemistry Vol 66, pp. 15728-15749 (2023)
- https://doi.org/10.1021/acs.jmedchem.3c00906
- Global serum profiling an opportunity for earlier cancer detection
- Sala Alexandra, Cameron James M, Brennan Paul M, Crosbie Emma J, Curran Tom, Gray Ewan, Martin-Hirsch Pierre, Palmer David S, Rehman Ihtesham U, Rattray Nicholas J W, Baker Matthew J
- Journal of Experimental & Clinical Cancer Research Vol 42 (2023)
- https://doi.org/10.1186/s13046-023-02786-y
- Augmentation of FTIR spectral datasets using Wasserstein generative adversarial networks for cancer liquid biopsies
- McHardy Rose G, Antoniou Georgios, Conn Justin J A, Baker Matthew J, Palmer David S
- Analyst Vol 148, pp. 3860-3869 (2023)
- https://doi.org/10.1039/D3AN00669G
- Recurrent neural networks for time domain modelling of FTIR spectra : application to brain tumour detection
- Antoniou Georgios, Conn Justin J A, Smith Benjamin R, Brennan Paul M, Baker Matthew J, Palmer David S
- Analyst Vol 148, pp. 1770-1776 (2023)
- https://doi.org/10.1039/D2AN02041F
- Solvation entropy, enthalpy and free energy prediction using a multi-task deep learning functional in 1D-RISM
- Fowles Daniel J, Palmer David S
- Physical Chemistry Chemical Physics Vol 25, pp. 6944-6954 (2023)
- https://doi.org/10.1039/D3CP00199G
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Research Interests
The main focus of my research is the development and application of molecular simulation and molecular informatics methods to solve industrially relevant problems at the interface between biochemistry and chemical physics. Recent examples have included the development of new methods for computational drug discovery (in collaboration with AstraZeneca, GSK, and Pfizer) and the design of an enzyme for use in food manufacturing (in collaboration with Chr. Hansen A/S). I am Founding Director of the cancer diagnostics company, Dxcover (formerly ClinSpec Diagnostics Ltd)
Professional Activities
- Spectroscopic Liquid Biopsies to Detect Cancer
- Speaker
- 29/11/2023
- Computational Chemistry Research in the Strathclyde Computational and Theoretical Chemistry Hub
- Speaker
- 29/10/2023
- Solubility Prediction: A Problem with a Solution?
- Speaker
- 4/10/2023
- Simultaneous Entropy, Enthalpy and Free Energy Prediction using a Physics-Informed Neural Network and Multi-task Learning
- Speaker
- 22/8/2023
- Cancer Detection using an AI-Enabled Spectroscopic Liquid Biopsy
- Speaker
- 9/8/2023
- Simultaneous Entropy, Enthalpy and Free Energy Prediction using a Physics-Informed Neural Network and Multi-task Learning
- Speaker
- 20/6/2023
Projects
- DTP 2224 University of Strathclyde | Falloon, Kierran
- Henrich, Oliver (Principal Investigator) Palmer, David (Co-investigator) Falloon, Kierran (Research Co-investigator)
- 01-Jan-2023 - 01-Jan-2027
- Afon Technology. Short Project
- Palmer, David (Principal Investigator)
- 01-Jan-2023 - 31-Jan-2023
- DTP 2224 University of Strathclyde | Fyfe, Calum
- Reid, Marc (Principal Investigator) Palmer, David (Co-investigator) Fyfe, Calum (Research Co-investigator)
- 01-Jan-2022 - 01-Jan-2027
- Doctoral Training Partnership 2020-2021 University of Strathclyde | Taylor, Madeleine
- Palmer, David (Principal Investigator) Reid, Marc (Co-investigator) Taylor, Madeleine (Research Co-investigator)
- 01-Jan-2021 - 01-Jan-2025
- Development of molecular-solvent interaction descriptors to improve accuracy of Quantitative Structure Retention Relationship model
- Palmer, David (Principal Investigator)
- 01-Jan-2021 - 31-Jan-2025
- Solvation thermodynamics of non-aqueous solvent in the 3D Reference Interaction Site Model (3D-RISM).
- Palmer, David (Principal Investigator)
- 256000 CPU hours awarded on Cirrus (EPSRC Tier-2 National HPC Facility at University of Edinburgh)
- 27-Jan-2021 - 27-Jan-2022
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Contact
Dr
David
Palmer
Reader
Pure and Applied Chemistry
Email: david.palmer@strath.ac.uk
Tel: 548 4178