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ORCIDAndrew Anighoro
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Journal Articles
- 2021
[j6]Rocco Meli
, Andrew Anighoro, Michael J. Bodkin, Garrett M. Morris, Philip C. Biggin:
Learning protein-ligand binding affinity with atomic environment vectors. J. Cheminformatics 13(1): 59 (2021)- 2016
- [j5]Andrew Anighoro, Jürgen Bajorath:
Binding mode similarity measures for ranking of docking poses: a case study on the adenosine A2A receptor. J. Comput. Aided Mol. Des. 30(6): 447-456 (2016) - [j4]Andrew Anighoro, Antonio de la Vega de León, Jürgen Bajorath:
Predicting bioactive conformations and binding modes of macrocycles. J. Comput. Aided Mol. Des. 30(10): 841-849 (2016) - [j3]Andrew Anighoro, Jürgen Bajorath:
Three-Dimensional Similarity in Molecular Docking: Prioritizing Ligand Poses on the Basis of Experimental Binding Modes. J. Chem. Inf. Model. 56(3): 580-587 (2016) - 2015
- [j2]Andrew Anighoro, Dagmar Stumpfe, Kathrin Heikamp, Kristin Beebe, Leonard M. Neckers, Jürgen Bajorath, Giulio Rastelli:
Computational Polypharmacology Analysis of the Heat Shock Protein 90 Interactome. J. Chem. Inf. Model. 55(3): 676-686 (2015) - 2013
- [j1]Andrew Anighoro, Giulio Rastelli:
Enrichment Factor Analyses on G-Protein Coupled Receptors with Known Crystal Structure. J. Chem. Inf. Model. 53(4): 739-743 (2013)
Informal and Other Publications
- 2022
- [i1]Paul Bertin, Jarrid Rector-Brooks, Deepak Sharma, Thomas Gaudelet, Andrew Anighoro, Torsten Gross, Francisco Martinez-Pena, Eileen L. Tang, Suraj M. S, Cristian Regep, Jeremy B. R. Hayter, Maksym Korablyov, Nicholas Valiante, Almer van der Sloot, Mike Tyers, Charles Roberts, Michael M. Bronstein, Luke L. Lairson, Jake P. Taylor-King, Yoshua Bengio:
RECOVER: sequential model optimization platform for combination drug repurposing identifies novel synergistic compounds in vitro. CoRR abs/2202.04202 (2022)
Coauthor Index
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