no code implementations • 3 Feb 2024 • Duy M. H. Nguyen, Nina Lukashina, Tai Nguyen, An T. Le, TrungTin Nguyen, Nhat Ho, Jan Peters, Daniel Sonntag, Viktor Zaverkin, Mathias Niepert
Contrary to prior work, we propose a novel 2D--3D aggregation mechanism based on a differentiable solver for the \emph{Fused Gromov-Wasserstein Barycenter} problem and the use of an efficient online conformer generation method based on distance geometry.
1 code implementation • 31 Mar 2022 • Christian Eichenberger, Moritz Neun, Henry Martin, Pedro Herruzo, Markus Spanring, Yichao Lu, Sungbin Choi, Vsevolod Konyakhin, Nina Lukashina, Aleksei Shpilman, Nina Wiedemann, Martin Raubal, Bo wang, Hai L. Vu, Reza Mohajerpoor, Chen Cai, Inhi Kim, Luca Hermes, Andrew Melnik, Riza Velioglu, Markus Vieth, Malte Schilling, Alabi Bojesomo, Hasan Al Marzouqi, Panos Liatsis, Jay Santokhi, Dylan Hillier, Yiming Yang, Joned Sarwar, Anna Jordan, Emil Hewage, David Jonietz, Fei Tang, Aleksandra Gruca, Michael Kopp, David Kreil, Sepp Hochreiter
The IARAI Traffic4cast competitions at NeurIPS 2019 and 2020 showed that neural networks can successfully predict future traffic conditions 1 hour into the future on simply aggregated GPS probe data in time and space bins.
1 code implementation • 5 Nov 2021 • Vsevolod Konyakhin, Nina Lukashina, Aleksei Shpilman
In this technical report, we present our solution to the Traffic4Cast 2021 Core Challenge, in which participants were asked to develop algorithms for predicting a traffic state 60 minutes ahead, based on the information from the previous hour, in 4 different cities.
2 code implementations • 24 Nov 2020 • Nina Lukashina, Alisa Alenicheva, Elizaveta Vlasova, Artem Kondiukov, Aigul Khakimova, Emil Magerramov, Nikita Churikov, Aleksei Shpilman
Lipophilicity is one of the factors determining the permeability of the cell membrane to a drug molecule.