QM/MM Best Practice Workshop webinar: Modeling catalytic mechanisms in carbohydrate-active enzymes with QM/MM MD methods (2021-01-12)
Carme Rovira presents the 7th QM/MM Best Practice workshop webinar: "Modeling catalytic mechanisms in carbohydrate-active enzymes with QM/MM MD methods"
QM/MM Best Practice Workshop webinar: Multiscale Simulation of Monoaminergic System: Applications to Neurodegeneration (2021-01-08)
Janez Mavri presents the 6th QM/MM Best Practice workshop webinar, "Multiscale Simulation of Monoaminergic System: Applications to Neurodegeneration"
Student Webinar: Winter School 2020 Edition (2021-01-18)
BioExcel’s webinar series continues with a special edition featuring student speakers
QM/MM Best Practice Workshop webinar: Towards chemical accuracy in QM/MM modelling of enzyme catalytic mechanisms and protein-ligand binding (2020-12-14) GalleryQM/MM Best Practice Workshop webinar: Towards chemical accuracy in QM/MM modelling of enzyme catalytic mechanisms and protein-ligand binding (2020-12-14)
QM/MM Best Practice Workshop webinar: Towards chemical accuracy in QM/MM modelling of enzyme catalytic mechanisms and protein-ligand binding (2020-12-14)
Adrian Mulholland presents the 5th QM/MM Best Practice workshop webinar, "Towards chemical accuracy in QM/MM modelling of enzyme catalytic mechanisms and protein-ligand binding"
QM/MM Best Practice Workshop webinar: Studies on enzyme-catalysed reactions (2020-12-10)
Maria João Ramos gives the fourth webinar in the BioExcel Virtual Workshop on Best Practices in QM/MM Simulation of Biomolecular Systems.
Webinar: Multiscale QM/MM simulations: exploring chemical reactions using novel GROMACS/CP2K interface (2020-12-08)
Dmitry Morozov introduces the GROMACS/CP2K QM/MM interface developed by BioExcel
