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Interactive Scientific Resources

Astex scientists have released a range of bespoke tools and software, which are available through the sections below. We hope they will be of benefit to the scientific community.

Software packages developed at Astex


Verdonk et al., “Protein–Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven “Force Field” for Biomolecular Interactions.” J. Med. Chem., 2016, 59 (14), pp 6891–6902.

DOI: 10.1021/acs.jmedchem.6b00716

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Rathi et al., “Practical High-Quality Electrostatic Potential Surfaces for Drug Discovery Using a Graph-Convolutional Deep Neural Network”, Journal of Medicinal Chemistry, 2020.

DOI: 10.1021/acs.jmedchem.9b01129

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F3UTER: Finding 3’UnTranslated Expressed Regions

Sethi et al., “Leveraging omic features with F3UTER enables identification of unannotated 3’UTRs for synaptic genes”

DOI: 10.1101/2021.03.08.434412

View software


For questions related to the overlay pages and other software described here, please contact us using the link below.