Andrew Plested · @andrewplested
237 followers · 668 posts · Server mstdn.science
Quantum mechanics of hydrated calcium in GluA2! Fun Collaboration as part of the #dynion @dfg_public research group.
Mechanism of Calcium Permeation in a #Glutamate Receptor #IonChannel #MolecularDynamics #QMMM
https://pubs.acs.org/doi/10.1021/acs.jcim.2c01494
Vol63 Issue4 #JCIM #compchem
#biophysics
#dynion #glutamate #IonChannel #moleculardynamics #QMMM #jcim #compchem #biophysics
Sven Klumpe · @sklumpe
23 followers · 3 posts · Server mstdn.science... and other techniques. My main drive is to push #cryoET in tissues to enable #structbio in #devbio systems and get the throughput with modern #cryoFIB systems needed to do #visualproteomics. Also, from a “former lifetime” still very much into #MD #QMMM #proteindesign #CompChem
#cryoET #structbio #DevBio #cryofib #visualproteomics #md #QMMM #Proteindesign #compchem
Chris Oostenbrink · @mms_boku
117 followers · 17 posts · Server wien.rocksWe have a position for a PhD student available! In the context of the @mscactions Doctoral Network #MetRaZymes we will be looking for a PhD student to use #machinelearning for #QMMM calculations on #metalloenzymes.
#MetRaZymes #machinelearning #QMMM #metalloenzymes