Biomolecular condensate phase diagrams with a combinatorial microdroplet platform WE Arter, R Qi, NA Erkamp, G Krainer, K Didi, TJ Welsh, J Acker, ... Nature Communications 13 (1), 7845, 2022 | 27 | 2022 |
Benchmarking Generated Poses: How Rational is Structure-based Drug Design with Generative Models? C Harris, K Didi, AR Jamasb, CK Joshi, SV Mathis, P Lio, T Blundell arXiv preprint arXiv:2308.07413, 2023 | 16 | 2023 |
MISATO: machine learning dataset of protein–ligand complexes for structure-based drug discovery T Siebenmorgen, F Menezes, S Benassou, E Merdivan, K Didi, ... Nature Computational Science, 1-12, 2024 | 6 | 2024 |
Assessing antibody and nanobody nativeness for hit selection and humanization with AbNatiV A Ramon, M Ali, M Atkinson, A Saturnino, K Didi, C Visentin, S Ricagno, ... Nature Machine Intelligence, 1-18, 2024 | 6 | 2024 |
Posecheck: Generative models for 3d structure-based drug design produce unrealistic poses C Harris, K Didi, A Jamasb, C Joshi, S Mathis, P Lio, T Blundell NeurIPS 2023 Generative AI and Biology (GenBio) Workshop, 2023 | 4 | 2023 |
Abnativ: vq-vae-based assessment of antibody and nanobody nativeness for engineering, selection, and computational design A Ramon, A Saturnino, K Didi, M Greenig, P Sormanni | 4 | 2023 |
Evaluating representation learning on the protein structure universe AR Jamasb, A Morehead, CK Joshi, Z Zhang, K Didi, SV Mathis, C Harris, ... The twelfth international conference on learning representations, 2024 | 3 | 2024 |
High resolution and multidimensional protein condensate phase diagrams with a combinatorial microdroplet platform WE Arter, R Qi, NA Erkamp, G Krainer, K Didi, TJ Welsh, J Acker, ... bioRxiv, 2020.06. 04.132308, 2020 | 3 | 2020 |
A framework for conditional diffusion modelling with applications in motif scaffolding for protein design K Didi, F Vargas, SV Mathis, V Dutordoir, E Mathieu, UJ Komorowska, ... arXiv preprint arXiv:2312.09236, 2023 | 1 | 2023 |
AbNatiV: VQ-VAE-based assessment of antibody and nanobody nativeness for hit selection, humanisation, and engineering A Ramon, M Ali, M Atkinson, A Saturnino, K Didi, C Visentin, S Ricagno, ... bioRxiv, 2023.04. 28.538712, 2023 | 1 | 2023 |
High Resolution Biomolecular Condensate Phase Diagrams with a Combinatorial Microdroplet Platform WE Arter, R Qi, NA Erkamp, G Krainer, K Didi, TJ Welsh, J Acker, ... | 1 | 2020 |
Flexible Structure-based Design of Small Molecules with Equivariant Diffusion Models A Schneuing, Y Du, C Harris, K Didi, A Jamasb, I Igashov, W Du, ... PROTEIN SCIENCE 32 (12), 2023 | | 2023 |
Modelling biology in novel ways-an AI-first course in Structural Bioinformatics K Didi, C Harris, P Lio, R Beck NeurIPS 2023 AI for Science Workshop, 2023 | | 2023 |
Dynamics-Informed Protein Design with Structure Conditioning UJ Komorowska, SV Mathis, K Didi, F Vargas, P Lio, M Jamnik The Twelfth International Conference on Learning Representations, 2023 | | 2023 |
BioModelsML: Building a FAIR and reproducible collection of machine learning models in life sciences and medicine for easy reuse DD Tiwari, N Hoffmann, K Didi, S Deshpande, S Ghosh, TVN Nguyen, ... bioRxiv, 2023.05. 22.540599, 2023 | | 2023 |
Flexible Small-Molecule Design and Optimization with Equivariant Diffusion Models C Harris, K Didi, A Schneuing, Y Du, AR Jamasb, MM Bronstein, ... ICLR 2023-Machine Learning for Drug Discovery workshop, 2023 | | 2023 |