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WolberLab @WolberLab

Joined October 2022
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WolberLab @WolberLab

11 months ago

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_toolkit @VTalagayev @YuChen_istry @Habacef @jchodera @orbeckst

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WolberLab @WolberLab

2 years ago

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 @VTalagayev @YuChen_istry @openmm_toolkit github.com/wolberlab/Open…

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Kristina Puls @KristinaPuls

3 years ago

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

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Kristina Puls @KristinaPuls

4 years ago

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!

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Marc Lucas Appis @MarcLucasAppis

3 years ago

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

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Theresa Noonan @TheresaNoonan7

3 years ago

I’m thrilled to share our review on the power of 3D pharmacophores in GPCR research (coincidentally also my first first-author publication) :) @gerhardwolber @KristinaPuls @TN_Nguyen92 mdpi.com/1900692

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Postdoc @BiochemOxford. PhD from @ShirtsGroupCU. Keen on compchem, deep learning & education. Rookie runner. Originally from Taiwan.
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