Code associated with the paper "Exploring and Mapping Chemical Space with Molecular Assembly Trees"
☆24Sep 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. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆23May 8, 2019Updated 7 years ago
- Package that facilitates pulling database entries from KEGG via its REST API☆12Updated this week
- 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 3 months ago
- some tools for working with protein (PDB) files in tensorflow☆11Jul 9, 2019Updated 6 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- AutoGraph: autonomous graph based clustering of metabolite conformations☆12Mar 25, 2022Updated 4 years ago
- Automated Monte Carlo Conformational Searching with Python☆17Nov 26, 2020Updated 5 years ago
- A NumPy port of the foldseek code for encoding protein structures to 3di.☆82Aug 22, 2025Updated 9 months ago
- Molecular Explanation Generator☆17Jan 26, 2022Updated 4 years ago
- ☆10Mar 2, 2021Updated 5 years ago
- A molecular integral code generator☆12Feb 7, 2016Updated 10 years ago
- ☆11Sep 16, 2024Updated last year
- systematic molecular fragmentation by annihilation☆11Nov 11, 2019Updated 6 years ago
- Automatically exported from code.google.com/p/pyplif☆10Nov 23, 2018Updated 7 years ago
- 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.
- 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 6 years ago
- Conservation analysis of homologous proteins with Python☆13Jul 11, 2021Updated 4 years ago
- Fast computation of a gaussian and its derivative on a grid.☆31May 20, 2026Updated 3 weeks ago
- A plain succulent 256-color neovim colorscheme using colorbuddy☆10May 28, 2024Updated 2 years ago
- Program to create tautomers and ionisation states relevant to physiological pH.☆10May 8, 2017Updated 9 years ago
- Website☆12Updated this week
- Extra functionality to integrate Org mode with Denote (such as Org dynamic blocks)☆21May 20, 2026Updated 3 weeks ago
- A plugin that enables synchronization of org todos and events with GCal☆19Dec 3, 2025Updated 6 months ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- ☆13Aug 20, 2020Updated 5 years ago
- Chemical Structure Handling for Pandas DataFrames☆34Feb 6, 2023Updated 3 years ago
- Smart window movement in neovim.☆16Feb 11, 2025Updated last year
- Revised breaking of retrosynthetically interesting chemical substructures (r-BRICS) – a revised BRICS module based on rdKit that breaks r…☆17Mar 14, 2025Updated last year
- Atomic Structure Generation from Reconstructing Structural Fingerprints☆15Oct 6, 2022Updated 3 years ago
- AI library developed in functional scala☆14Dec 28, 2015Updated 10 years ago
- Extract ligands from original PDB file☆10Nov 1, 2019Updated 6 years ago
- ☆15Nov 29, 2023Updated 2 years ago
- Description, readme and source-files for crystIT, a python based program to calculated complexity measures for crystal structures based o…☆16Dec 24, 2025Updated 5 months ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- A simple orgmode editor inspired by nano and k9s☆29Feb 17, 2026Updated 3 months ago
- A high-performance, lock-free concurrent cuckoo filter implementation in Rust☆29Jan 25, 2026Updated 4 months ago
- Given an RDKit molecule that does not sanitise, correct it until it does☆44Apr 5, 2024Updated 2 years ago
- A collection of my configuration files 📦☆11May 26, 2026Updated 2 weeks ago
- Code associated to the paper "The temporal dynamics of group interactions in higher-order social networks" by Iacopini et al. Nature Comm…☆19Sep 9, 2024Updated last year
- Conventional Commits source for blink.cmp☆35Apr 20, 2026Updated last month
- A third-party distribution of Multiwfn for gfortran, 100% free!☆19Jul 31, 2018Updated 7 years ago