#diffdock

Latest posts tagged with #diffdock on Bluesky

Trending

#Ukraine Conflict #U.S. Foreign Policy #F1 #Chinese Grand Prix #SNL #Venezuela Baseball #AEW Collision #Six Nations #Newcastle United #Arsenal vs Everton #Ukraine Conflict #U.S. Foreign Policy #F1 #Chinese Grand Prix #SNL #Venezuela Baseball #AEW Collision #Six Nations #Newcastle United #Arsenal vs Everton

Posts tagged #diffdock

Ken Koon Wong

@kenkoonwong.bsky.social

3 weeks ago

Assessing TEM, CTX-M, and KPC2 With Molecular Docking and Molecular Dynamic Simulation | Everyday Is A School Day 🧬 Testing beta-lactamase resistance with AlphaFold + DiffDock + GROMACS! Watch clavulanic acid bind TEM-5, CTX-M-15, KPC-2, and get rejected by TEM-30. Simulation confirms biology! 🔬💊

🧬 Testing beta-lactamase resistance with AlphaFold + DiffDock + GROMACS! Watch clavulanic acid bind TEM-5, CTX-M-15, KPC-2, and get rejected by TEM-30. Simulation confirms biology! 🔬💊 #gromacs #diffdock #chimerax #moleculardynamic #alphafold

4 1 0 0

Gautam

@gautammalik.bsky.social

1 year ago

A young researcher’s perspective on the #DiffDock discussion between @gcorso.bsky.social and @prof-ajay-jain.bsky.social:

Honestly, I’m feeling both thrilled and a little lost. As someone new to the field, I can’t help but reflect on what this means for the future of docking and AI/ML in science.

0 0 2 0

Latitude77

@latitude77.bsky.social

1 year ago

Deep-Learning Based Docking Methods: Fair Comparisons to Conventional Docking Workflows #molecularmodeling #docking #deeplearning #diffdock #benchmark

0 0 0 0