Imputation of sensory properties using deep learning – ACS Spring 22

by Thanos Panagiotidis | Mar 21, 2022 | Drug Discovery Applications, Publications and presentations

Imputation of sensory properties using deep learning – ACS Spring 22 Presented by Dmitriy Chekmarev (IFF) and Samar Mahmoud (Optibrium), on 20 March 2022 at the ACS National Meeting and Exposition, USA Presentation Overview We demonstrate how Augmented...

Practical Applications of Deep Learning to Impute Heterogeneous Drug Discovery Data

by Thanos Panagiotidis | Apr 29, 2020 | Drug Discovery Applications, Publications and presentations

Practical Applications of Deep Learning to Impute Heterogeneous Drug Discovery Data Preprint Paper. Abstract Contemporary deep learning approaches still struggle to bring a useful improvement in the field of drug discovery due to the challenges of sparse, noisy and...

Practical Applications of Deep Learning to Imputation of Drug Discovery Data

by Thanos Panagiotidis | Sep 4, 2019 | Drug Discovery Applications, Publications and presentations

Practical Applications of Deep Learning to Imputation of Drug Discovery Data Presented by Ben Irwin, on 28 August 2019 at the ACS National Meeting and Exposition in San Diego, USA Presentation Overview Problems with pharma data − Define solutions to these problems...

N- and S-Oxidation Model of the Flavin-containing Monooxygenases

by Thanos Panagiotidis | Jul 3, 2019 | Drug Discovery Applications, Publications and presentations

N- and S-Oxidation Model of the Flavin-containing Monooxygenases This poster was presented at the Eighth Joint Sheffield Conference on Chemoinformatics; 17-19 June 2019 Peter Walton, Mario Öeren, Peter Hunt, Matthew Segall Existing computational models of drug...

Bigfoot, the Loch Ness Monster, and Halogen Bonds

by Thanos Panagiotidis | Nov 22, 2018 | Drug Discovery Applications, Publications and presentations

Bigfoot, the Loch Ness Monster, and Halogen Bonds At the 2018 Streamlining Drug Discovery Symposium in San Diego, David Lawson treated us to this illuminating presentation entitled Bigfoot, the Loch Ness Monster, and Halogen Bonds: Separating Rumors from Reality in...

A Novel Scoring Profile for the Design of Antibacterials Active Against Gram-Negative Bacteria

by Thanos Panagiotidis | Nov 16, 2018 | Drug Discovery Applications, Publications and presentations

A Novel Scoring Profile for the Design of Antibacterials Active Against Gram-Negative Bacteria At the 2nd SCI/RSC Symposium on Antimicrobial Drug Discovery, 12-13 November 2018, Bailey Montefiore, Optibrium – Franca Klingler, BioSolveIT – Nicholas Foster,...
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