D.S. Williamson

Universidade de Santiago de Compostela — Spain

Computer Science · Physical Sciences

20h-index1.7kcitations65works2.32yr avg
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Research Topics

Computational Drug Discovery Methods(10), Heat shock proteins research(9), 14-3-3 protein interactions(8), Radical Photochemical Reactions(6), Plant biochemistry and biosynthesis(6)

Publications64 total

Chemical shift prediction in 13C NMR spectroscopy using ensembles of message passing neural networks (MPNNs)
Journal of Magnetic Resonance·2024· 6 citedOpen Access
Abstract 3231: Pharmacological inhibition of the m6A RNA reader, YTHDC1, as a novel approach to targeting biomolecular condensates in cancer
Cancer Research·2024· 1 cited
Abstract 1657: Microfluidics-based screening platform identifies a novel therapeutic approach to targeting EML4-ALK driven cancers
Cancer Research·2024
Design and Synthesis of Pyrrolo[2,3-<i>d</i>]pyrimidine-Derived Leucine-Rich Repeat Kinase 2 (LRRK2) Inhibitors Using a Checkpoint Kinase 1 (CHK1)-Derived Crystallographic Surrogate
Journal of Medicinal Chemistry·2021· 36 citedOpen Access
Crystal structure of CHK1 complex with compound 9
2021
Crystal structure of CHK1-10pt-mutant complex with compound 32
2021
Crystal structure of CHK1-10pt-mutant complex with compound 9
2021
Crystal structure of CHK1-10pt-mutant complex with adenine
2021
Crystal structure of CHK1-10pt-mutant complex with compound 3
2021
Crystal structure of CHK1-10pt-mutant complex with compound 26
2021
Crystal structure of CHK1-10pt-mutant complex with compound 18
2021
Establishing Drug Discovery and Identification of Hit Series for the Anti-apoptotic Proteins, Bcl-2 and Mcl-1
ACS Omega·2019· 68 citedOpen Access
T114. Behavioral Changes and Glial Staining in Mice Subjected to the Chronic Social Defeat Stress Followed by Electroconvulsive Stimulation
Biological Psychiatry·2019
Structure of human Bcl-2 in complex with fragment/ABT-263 hybrid
2019
Structure of human Bcl-2 in complex with THIQ-phenyl pyrazole compound
2019
Structure of human Mcl-1 in complex with thienopyrimidine inhibitor
2019
Structure of human Bcl-2 in complex with analogue of ABT-737
2019
Structure of human Mcl-1 in complex with BIM BH3 peptide
2019
Recent Progress in Leucine-Rich Repeat Kinase 2 (LRRK2) Inhibitors for the Treatment of Parkinson's Disease
Medicinal chemistry reviews·2018· 1 cited
LRRK2 exonic variants associated with Parkinson’s disease augment phosphorylation levels for LRRK2-Ser1292 and Rab10-Thr73
2018· 15 citedOpen Access
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Frequent Co-authors

P. Dokurno(23), A.E. Surgenor(17), James B. Murray(10), T. Shaw(9), Allan M. Jordan(9), Natalia Matassova(7), Geraint L. Francis(7), Yikang Wang(7), Kenneth Vielsted Christensen(7), Jenifer Borgognoni(6), Rob Howes(6), Garrick P. Smith(6), Jonathan D. Moore(6), Andrew J. Massey(5), Alba T. Macias(5), Zoe Daniels(5), Christopher J Graham(5), Martin J. Drysdale(5), Philip S. Jackson(5), Roger J. Gillespie(5)