Our paper about the mechanistic characterization of the pharmacological profile of HS-731, a peripherally acting opioid analgesic, at the µ-, δ-, κ-opioid and nociceptin receptors is now published. You can find the free access paper at mdpi.com/1420-3049/27/3… Thank you all!

Yesterday it was my great pleasure to speak about digital PCR and BLI for #cancer research at the BCPS Symposium taking place Department Biology, Chemistry, Pharmacy FU Berlin The BCPS is a conference for students (bachelor to PhD level) organized by students from the young chemists forum Berlin JCF Berlin

I’m thrilled to share our review on the power of 3D pharmacophores in GPCR research (coincidentally also my first first-author publication) :) Gerhard Wolber Kristina Puls Trung Ngoc Nguyen mdpi.com/1900692

Check out the solution of the riddle: mdpi.com/1420-3049/28/2… The study evaluates massive experimental data and conflicting hypotheses to shed light on the often addressed but unknown binding mode of Salvinorin A at the kappa opioid receptor #ERNEST #GPCR #drugdesign WolberLab

Exciting updates to our OpenMMDL workflow! We have added A) an Amber path for OpenMMDL-setup and B) protein-ligand interaction and binding mode analysis Valerij Talagayev Yu Chen OpenMM github.com/wolberlab/Open…

We are excited to share the update that our project OpenMMDL has been accepted as MDAKit, now available at MDAnalysis mdanalysis.org and via conda forge github.com/wolberlab/Open… OpenMM Valerij Talagayev Yu Chen Leon O John Chodera (he/him) @orbeckst