ICML 2023 Topological Deep Learning Challenge : Design and Results

1 code implementation • 26 Sep 2023 • Mathilde Papillon, Mustafa Hajij, Helen Jenne, Johan Mathe, Audun Myers, Theodore Papamarkou, Tolga Birdal, Tamal Dey, Tim Doster, Tegan Emerson, Gurusankar Gopalakrishnan, Devendra Govil, Aldo Guzmán-Sáenz, Henry Kvinge, Neal Livesay, Soham Mukherjee, Shreyas N. Samaga, Karthikeyan Natesan Ramamurthy, Maneel Reddy Karri, Paul Rosen, Sophia Sanborn, Robin Walters, Jens Agerberg, Sadrodin Barikbin, Claudio Battiloro, Gleb Bazhenov, Guillermo Bernardez, Aiden Brent, Sergio Escalera, Simone Fiorellino, Dmitrii Gavrilev, Mohammed Hassanin, Paul Häusner, Odin Hoff Gardaa, Abdelwahed Khamis, Manuel Lecha, German Magai, Tatiana Malygina, Rubén Ballester, Kalyan Nadimpalli, Alexander Nikitin, Abraham Rabinowitz, Alessandro Salatiello, Simone Scardapane, Luca Scofano, Suraj Singh, Jens Sjölund, Pavel Snopov, Indro Spinelli, Lev Telyatnikov, Lucia Testa, Maosheng Yang, Yixiao Yue, Olga Zaghen, Ali Zia, Nina Miolane

This paper presents the computational challenge on topological deep learning that was hosted within the ICML 2023 Workshop on Topology and Geometry in Machine Learning.

Anomaly Detection in Networks via Score-Based Generative Models

1 code implementation • 27 Jun 2023 • Dmitrii Gavrilev, Evgeny Burnaev

Node outlier detection in attributed graphs is a challenging problem for which there is no method that would work well across different datasets.

Anomaly Detection Outlier Detection

High Performance of Gradient Boosting in Binding Affinity Prediction

no code implementations • 14 May 2022 • Dmitrii Gavrilev, Nurlybek Amangeldiuly, Sergei Ivanov, Evgeny Burnaev

Prediction of protein-ligand (PL) binding affinity remains the key to drug discovery.

Drug Discovery Protein-Ligand Affinity Prediction +1