Code associated with the paper "Exploring and Mapping Chemical Space with Molecular Assembly Trees"
☆23Sep 29, 2021Updated 4 years ago
Alternatives and similar repositories for Paper-AssemblyTreeOfLife
Users that are interested in Paper-AssemblyTreeOfLife are comparing it to the libraries listed below
Sorting:
- Package that facilitates pulling database entries from KEGG via its REST API☆11Feb 21, 2026Updated last month
- This repo is deprecated. I move the work to support molstar in nglview: https://github.com/nglviewer/nglview☆12Dec 3, 2024Updated last year
- substructure search in large combinatorial spaces using openchemlib☆23Mar 6, 2026Updated 2 weeks ago
- some tools for working with protein (PDB) files in tensorflow☆11Jul 9, 2019Updated 6 years ago
- AutoGraph: autonomous graph based clustering of metabolite conformations☆12Mar 25, 2022Updated 3 years ago
- A NumPy port of the foldseek code for encoding protein structures to 3di.☆79Aug 22, 2025Updated 6 months ago
- Automated Monte Carlo Conformational Searching with Python☆17Nov 26, 2020Updated 5 years ago
- 👨💻 A personalized NeoVim from scratch with all the features that I want for 100% comfortable development.☆14Updated this week
- Molecular Explanation Generator☆17Jan 26, 2022Updated 4 years ago
- ☆10Mar 2, 2021Updated 5 years ago
- ☆11Sep 16, 2024Updated last year
- systematic molecular fragmentation by annihilation☆11Nov 11, 2019Updated 6 years ago
- completion.☆11May 15, 2025Updated 10 months ago
- Automatically exported from code.google.com/p/pyplif☆10Nov 23, 2018Updated 7 years ago
- Code to accompany "Practical Cheminformatics With Open Source Software"☆16Feb 24, 2022Updated 4 years ago
- The High Performance Collision Cross Section (HPCCS) is a new software for fast and accurate calculation of CCS for molecular ions. Based…☆17May 11, 2020Updated 5 years ago
- Contact management and autocomplete system for Neovim.