ENHANCING ACCURACY OF VIRTUAL KINASE PROFILING VIA APPLICATION OF GRAPH NEURAL NETWORK TO 3D PHARMACOPHORE ENSEMBLES ArticleEreshchenko Alexey V., Evteev Sergei, Malyshev Alexander S., Adjugim Denis, Sizov Fedor, Pastukhova Anna S., Terentiev Victor A., Shegai Peter V., Kaprin Andrey D., Ivanenkov Yan A.Journal of Computer-Aided Molecular Design. Том 39. 2025.