TY  - JOUR
AU  - van der Weg, Karel
AU  - Merdivan, Erinc
AU  - Piraud, Marie
AU  - Gohlke, Holger
TI  - TopEC: prediction of Enzyme Commission classes by 3D graph neural networks and localized 3D protein descriptor
JO  - Nature Communications
VL  - 16
IS  - 1
SN  - 2041-1723
CY  - [London]
PB  - Springer Nature
M1  - FZJ-2025-02043
SP  - 2737
PY  - 2025
LB  - PUB:(DE-HGF)16
C6  - 40108108
UR  - <Go to ISI:>//WOS:001469448400003
DO  - DOI:10.1038/s41467-025-57324-5
UR  - https://juser.fz-juelich.de/record/1040890
ER  -