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Current Opinion in Structural Biology|March 31, 2023
Deep generative models for 3D molecular structureBenoit Baillif, Jason Cole, Patrick McCabe, et al.Journal of Cheminformatics|December 22, 2023
Applying atomistic neural networks to bias conformer ensembles towards bioactive-like conformationsBenoit Baillif, Jason Cole, Ilenia Giangreco, et al.Journal of Chemical Information and Modeling|April 22, 2014
Kernel density estimation applied to bond length, bond angle, and torsion angle distributionsPatrick McCabe, Oliver Korb, Jason ColeJournal of Chemical Information and Modeling|October 4, 2011
The ensemble performance index: an improved measure for assessing ensemble pose prediction performanceOliver Korb, Patrick McCabe, Jason ColeJournal of Chemical Information and Modeling|August 12, 2014
Knowledge-based libraries for predicting the geometric preferences of druglike moleculesRobin Taylor, Jason Cole, Oliver Korb, et al.Methods in Molecular Biology (Clifton, N.J.)|September 15, 2010
Bayesian methods in virtual screening and chemical biologyAndreas BenderExpert Opinion on Drug Discovery|July 25, 2012
How similar are those molecules after all? Use two descriptors and you will have three different answersAndreas BenderNature Communications|January 5, 2020
De novo generation of hit-like molecules from gene expression signatures using artificial intelligenceOscar Méndez-Lucio, Benoit Baillif, Djork-Arné Clevert, et al.The Journal of Foot and Ankle Surgery : Official Publication of the American College of Foot and Ankle Surgeons|May 14, 2019
Pretibial Panniculitis Ossificans-A Rare but Significant DiagnosisPatrick McCabe, Thomas BayerBMC Neurology|February 1, 2019
Correction to: Concordance analysis of microarray studies identifies representative gene expression changes in Parkinson's disease: a comparison of 33 human and animal studiesErin Oerton, Andreas BenderPageof 48