Sjoerd de Vries's repositories

seamless

Seamless is a framework to set up reproducible computations (and visualizations) that respond to changes in cells. Cells contain the input data as well as the source code of the computations, and all cells can be edited interactively.

Language:PythonLicense:NOASSERTIONStargazers:20Issues:2Issues:222

attract

ATTRACT program suite for macromolecular docking (protein-protein, protein-nucleic acid, protein-peptide)

Language:PythonLicense:GPL-3.0Stargazers:15Issues:0Issues:0
Language:ShellStargazers:0Issues:4Issues:0

alphafold

Open source code for AlphaFold.

Language:PythonLicense:Apache-2.0Stargazers:0Issues:0Issues:0
Language:PythonStargazers:0Issues:1Issues:0
Language:PythonStargazers:0Issues:0Issues:0
Language:PythonLicense:NOASSERTIONStargazers:0Issues:0Issues:0

biopython

Official git repository for Biopython (originally converted from CVS)

Language:PythonLicense:NOASSERTIONStargazers:0Issues:0Issues:0

capri-targets

Automatic CAPRI target identification

Language:Jupyter NotebookLicense:MITStargazers:0Issues:0Issues:0

cloudless

Workload manager and web front end for Seamless

Language:PythonLicense:NOASSERTIONStargazers:0Issues:1Issues:1

ColabFold

Making Protein folding accessible to all via Google Colab!

Language:Jupyter NotebookLicense:MITStargazers:0Issues:0Issues:0

consero

Assembly docking poses of fragments in PDB formats into full all-atoms models

License:GPL-3.0Stargazers:0Issues:0Issues:0
Language:PythonLicense:NOASSERTIONStargazers:0Issues:1Issues:0

dask-jobqueue

Deploy Dask on job schedulers like PBS, SLURM, and SGE

Language:PythonLicense:BSD-3-ClauseStargazers:0Issues:0Issues:0
Stargazers:0Issues:0Issues:0

docking_py

Docking_py is a python library allowing a simplified use of the Smina, vina, qvina2 and qvinaw docking software. Docking_py can be easily automatize and scripted.

Language:PythonLicense:GPL-2.0Stargazers:0Issues:0Issues:0
Language:C++Stargazers:0Issues:0Issues:0

hashserver

ASGI file server that serves Seamless buffers

Language:PythonLicense:NOASSERTIONStargazers:0Issues:1Issues:0
Language:PythonStargazers:0Issues:1Issues:0
Language:PythonStargazers:0Issues:1Issues:0

nademo

Nucleid acid demo using Seamless

Language:Jupyter NotebookLicense:BSD-2-ClauseStargazers:0Issues:0Issues:0

nefertiti

Near-native Ensemble Fragments: Enumeration, Rotation, Translation, In a short TIme

Language:PythonLicense:NOASSERTIONStargazers:0Issues:1Issues:0
Language:PythonStargazers:0Issues:1Issues:0

ProtNAff

Multi-Purpose Structural Database of Nucleic-Acid/Protein Complexes

Language:Jupyter NotebookLicense:GPL-3.0Stargazers:0Issues:0Issues:0
Language:PythonLicense:NOASSERTIONStargazers:0Issues:0Issues:0

seamless-binder-demo

A collection of Seamless demo notebooks, to be run via mybinder.org

Language:Jupyter NotebookLicense:NOASSERTIONStargazers:0Issues:0Issues:0
Language:ShellLicense:UnlicenseStargazers:0Issues:0Issues:0

seamless-tools

This repo contains tools related to the deployment of Seamless

Language:PythonLicense:NOASSERTIONStargazers:0Issues:0Issues:0

silk

Library for schema validation, object-oriented API wrappers (like ECMAS prototypes), and mixed JSON/binary serialization.

Language:PythonLicense:MITStargazers:0Issues:0Issues:0
License:GPL-3.0Stargazers:0Issues:0Issues:0