a *biosynformatic* fingerprint to explore natural product distance and diversity

Small crate to measure the time requirements of syn parsing with different usages.

The CSV magician

🪴 A Terminal User Interface (TUI) to manage your tasks with minimal kanban logic

Python and Rust library for loading, saving, and manipulating taxonomic trees

Sophia: a Rust toolkit for RDF and Linked Data

A Rust library for parsing ProForma peptides and matching them against MS spectra, formally known as rustyms

Robust representation of semantically constrained graphs, in particular for molecules in chemistry

A Shiny web app for creating worklists for LC-MS experiments

HTTP server and database for tracking and searching chemicals

Chromascope is a lightweight GUI application designed for visualizing mass spectrometry data.

asari, metabolomics data preprocessing

PyRate is a program to estimate speciation, extinction, and preservation rates from fossil occurrence data using a Bayesian framework.

Rust crate that provides an ergonomic way to define data models that are seamlessly converted into IndexedDB object stores, utilizing derive macros.

A curated list of various semantic web and linked data resources.

A clean documentation and blog theme for your Hugo site based on Bootstrap 5

Hugo website with a map to practice collaboration in class

Hugo Shortcodes for inserting a OSM Map, Marker or Track into your posts by using leaflet

Work with BagIt packages from Python.

HUPO-PSI mass spectrometry CV

Python package helping to work with the MESH dataset.

Write up on how to use compact identifiers in project reports.

An extremely fast Python package and project manager, written in Rust.

FORRT Website

SIRIUS is a software for discovering a landscape of de-novo identification of metabolites using tandem mass spectrometry. This repository contains the code of the SIRIUS Software (GUI and CLI)

The MinHashed Atom Pair fingerprint of radius 2