hubertrybka
PhD student, member of Bioorganic and Medicinal Chemistry Group at Jagiellonian University
Jagiellonian UniversityKrakow
Pinned Repositories
mldd23_project1
ml2017
Repository for course Machine Learning at JU
ml2023-24
Materials for the 2022/23 edition of Machine Learning classes.
mldd23
The repository for the course "Machine Learning in Drug Design" taught at the Jagiellonian University in 2023. The page is hosted by the machine learning research group GMUM.
profis
Design of target-focused libraries by probing continuous fingerprint space with recurrent neural networks. The repository accompanies a research paper which is currently under review (08.04.24)
pum-24
Course materials for the 2024/2025 edition of the Basics of Machine Learning (Podstawy uczenia maszynowego) course taught at the Faculty of Chemistry, Jagiellonian University in Kraków
vae-annealing
A simple pytorch implementation for calculating VAE loss components and annealing KLD loss while training VAEs, especially RNN-based
pymol-open-source
Open-source foundation of the user-sponsored PyMOL molecular visualization system.
gmx_MMPBSA
gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
dynophores
Dynamic pharmacophore modeling of molecular interactions
hubertrybka's Repositories
hubertrybka/vae-annealing
A simple pytorch implementation for calculating VAE loss components and annealing KLD loss while training VAEs, especially RNN-based
hubertrybka/profis
Design of target-focused libraries by probing continuous fingerprint space with recurrent neural networks. The repository accompanies a research paper which is currently under review (08.04.24)
hubertrybka/pum-24
Course materials for the 2024/2025 edition of the Basics of Machine Learning (Podstawy uczenia maszynowego) course taught at the Faculty of Chemistry, Jagiellonian University in Kraków
hubertrybka/ml2017
Repository for course Machine Learning at JU
hubertrybka/ml2023-24
Materials for the 2022/23 edition of Machine Learning classes.
hubertrybka/mldd23
The repository for the course "Machine Learning in Drug Design" taught at the Jagiellonian University in 2023. The page is hosted by the machine learning research group GMUM.