Links
packages = ["numpy"]
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Python Packages
Molecular parsing & analysis
Ligand categorisaton and segmentation
Compound sampling and optimisation
Publications
PhD Thesis
Nature Sci. Rep.
J. Phys. Chem. B
J. Phys. Chem. Lett.
Nature Comm. Chem.
MPhys Dissertation
Posters
'Best Industrial Poster' Prize Winner at 9th RSC-BMCS Fragment based Drug Discovery Meeting in 2024
'Digital Discovery' Prize Winner at the 5th CCPBioSim/CCP5 Manchester Multiscale Conference in 2023
Presented at the ISQBP President's Meeting 2022
"People's Vote Best Poster" Prize Winner at the 2022 University of Surrey Doctoral College Conference
Other Projects
FPL Analysis
Photography