1 citations · 1 across the 2 of their papers we have counts for
4 papers
Bolek: A Multimodal Language Model for Molecular Reasoning
Frederic Grabowski, Jacek Szczerbiński, Maciej Jaśkowski +4
Molecular property models increasingly support high-stakes drug-discovery decisions, but their outputs are often difficult to audit: classical predictors return scores without rati…
RapidDock: Unlocking Proteome-scale Molecular Docking
Rafał Powalski, Bazyli Klockiewicz, Maciej Jaśkowski +6
Accelerating molecular docking -- the process of predicting how molecules bind to protein targets -- could boost small-molecule drug discovery and revolutionize medicine. Unfortuna…
A topological selection of folding pathways from native states of knotted proteins
Agnese Barbensi, Naya Yerolemou, Oliver Vipond +3
Understanding the biological function of knots in proteins and their folding process is an open and challenging question in biology. Recent studies classify the topology and geomet…
-curves in proteins
Pawel Dabrowski-Tumanski, Dimos Goundaroulis, Andrzej Stasiak +1
Apart from the knots formed by the main-chain, the proteins can form numerous topological structures, when included the covalent and ion-mediated interactions. In this work, we def…