Pinned Repositories
bioicons
A library of free open source icons for science illustrations in biology and chemistry
DiffDock
Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
folding_tools
A collection of *fold* tools
jupyter-master
mars-biohackathon
Predicting thermostability using a VAE and prediction from the latent space.
MolecularNodes
Addon and nodes for working with structural biology and molecular data in Blender.
molecule2d
normal-mode-jupyter
substrate-scope-plot
VCMS
A virtual conference management system that provides tools to manage virtual poster sessions.
duerrsimon's Repositories
duerrsimon/bioicons
A library of free open source icons for science illustrations in biology and chemistry
duerrsimon/folding_tools
A collection of *fold* tools
duerrsimon/jupyter-master
duerrsimon/molecule2d
duerrsimon/DiffDock
Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
duerrsimon/MolecularNodes
Addon and nodes for working with structural biology and molecular data in Blender.
duerrsimon/repo_selective_sync_remove_solutions
duerrsimon/.github
duerrsimon/3dmol_svelte_surface
duerrsimon/bioicons-blog
duerrsimon/bioicons-test
duerrsimon/biopython
Official git repository for Biopython (originally converted from CVS)
duerrsimon/blog
Public repo for HF blog posts
duerrsimon/colab-db.github.io
Repository of Jupyter Notebooks on Colab, Binder and Huggingface for Bio, Chemistry and Physics
duerrsimon/dev-portfolio-2.0
duerrsimon/FBModel
duerrsimon/gradio
Create UIs for your machine learning model in Python in 3 minutes
duerrsimon/gradio-block
duerrsimon/hayfeeder
Automatic Hayfeeder using Arduino R4
duerrsimon/jb-toc-bug
duerrsimon/jb_clone_public
duerrsimon/ketcher
Web-based molecule sketcher
duerrsimon/MetalHawk
A machine learning-based approach for metal site geometry
duerrsimon/moleculekit
MoleculeKit: Your favorite molecule manipulation kit
duerrsimon/penguins-rdm
Some sample files to polish for publication on zenodo.
duerrsimon/ProteinMPNN
Code for the ProteinMPNN paper
duerrsimon/RoseTTAFold-All-Atom
duerrsimon/serverless
The Power of Serverless for Front-End Developers
duerrsimon/the-turing-way
Host repository for The Turing Way: a how to guide for reproducible data science
duerrsimon/vue_3dmol_gradio