Container-based installation of pymol, with interaction through the browser via Jupyter notebook
☆20May 22, 2019Updated 6 years ago
Alternatives and similar repositories for jupyter-docker-pymol
Users that are interested in jupyter-docker-pymol are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Pharmacophore tool based on OpenEye toolkits☆10Feb 22, 2016Updated 10 years ago
- Parse a SDF file and convert it to an array of objects☆12Feb 19, 2026Updated 2 months ago
- ☆12Dec 12, 2024Updated last year
- Control PyMOL sessions via IPython☆61Nov 3, 2022Updated 3 years ago
- 2018 RDKit UGM☆14Sep 28, 2018Updated 7 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Visual Molecular Dynamics in Docker Container☆12Jan 1, 2015Updated 11 years ago
- Data files for the molecular modelling course☆13Jan 26, 2024Updated 2 years ago
- Open-source docking pipeline leveraging pairwise statistics☆15Jul 26, 2024Updated last year
- Installing packages with pip and conda☆16Jun 17, 2020Updated 5 years ago
- mGPfusion is a Gaussian process based method for predicting stability changes upon single and multiple mutations of proteins that comple…☆15May 24, 2018Updated 7 years ago
- ☆37May 31, 2021Updated 4 years ago
- Create interactive quizzes using Shiny and Rmarkdown☆16Aug 18, 2024Updated last year
- Automatically exported from code.google.com/p/acpype☆12May 11, 2015Updated 10 years ago
- Energy minimization post-processing used in PoseBusters☆14Apr 4, 2025Updated last year
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Rigid body fitting of atomic strucures in cryo-electron microscopy density maps☆22Apr 30, 2026Updated last week
- ☆15Apr 30, 2026Updated last week
- GPU accelerating computing for Bayesian inference of electron microscopy images. BioEM is a publicly available software that enables the …☆11Apr 7, 2023Updated 3 years ago
- Streamlined version of VirtualFlow combining both VFVS and VFLP☆22Jun 2, 2023Updated 2 years ago
- Python toolkit for pre- and post-processing of FMO calculations☆17Jan 24, 2026Updated 3 months ago
- Uni-Dock-Benchmarks contains a curated collection of datasets and benchmarking tests for evaluating the performance and accuracy of the U…☆18Feb 11, 2026Updated 2 months ago
- Deep Learning-based Bioisosteric Replacements for Optimization of Multiple Molecular Properties☆30Updated this week
- A library for reactive data visualizations (Work in progress)☆15Jul 20, 2016Updated 9 years ago
- Intelligent System for Analysis, Model Building And Rational Design of biomolecules.☆26Mar 11, 2021Updated 5 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Assessing the impact of mutations on antibody-antigen binding affinity☆18Dec 7, 2020Updated 5 years ago
- d3fc financial components for R☆11Mar 21, 2017Updated 9 years ago
- ChemCharts is a module that allows you to plot chemical space in various figure types☆16Sep 24, 2023Updated 2 years ago
- RDKit Tools for the IPython Notebook☆46Oct 16, 2018Updated 7 years ago
- A series of scripts that facilitate the prediction of protein structures in multiple conformations using AlphaFold2☆98Aug 29, 2023Updated 2 years ago
- WebAssembly N-body simulation benchmark☆17Jan 20, 2023Updated 3 years ago
- ☆19Jan 17, 2025Updated last year
- Repository for MD methods and analysis from submitted or published work☆20Jun 10, 2023Updated 2 years ago
- ☆18Dec 2, 2024Updated last year
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- GitHub for AI4PD 2023 Workshop in Chile☆12Oct 12, 2023Updated 2 years ago
- Chainer implementation of Graph Neural Networks for the Prediction of Substrate-Specific Organic Reaction Conditions☆10Apr 11, 2021Updated 5 years ago
- A toolkit developed to predict and analyze PROTAC-mediated ternary complexes using AlphaFold3 and Boltz-1.☆41Jul 17, 2025Updated 9 months ago
- FragIt main repository☆28Mar 6, 2026Updated 2 months ago
- cryo_fit1 source codes, test files, live at .../phenix-xxxx/modules☆10Mar 25, 2022Updated 4 years ago
- A Python script for rendering cube files generated by Psi4☆19Mar 30, 2025Updated last year
- A cheminformatics extension for the SQLAlchemy database toolkit.☆40Sep 11, 2025Updated 7 months ago