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
PLI
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.
ESP_DNN
Rathi et al., “Practical High-Quality Electrostatic Potential Surfaces for Drug Discovery Using a Graph-Convolutional Deep Neural Network”, Journal of Medicinal Chemistry, 2020.
F3UTER: Finding 3’UnTranslated Expressed Regions
Sethi et al., “Leveraging omic features with F3UTER enables identification of unannotated 3’UTRs for synaptic genes”
Contact
For questions related to the overlay pages and other software described here, please contact us using the link below.
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