Bare bones approach to two-way string passing - without wasm-bindgen.
A short, no-frills guide from blank project to running code.
Some simple tricks go a long way when dealing with iterators as return values.
First steps toward bringing ChemCore to a Python interpreter near you.
On the differences - and similarities - between implicit and virtual hydrogens.
Design, implementation, and future prospects.
Toward a suite of toolkit-agnostic utilities for the SMILES language.
The fine art of dealing with what isn't there.
Laying the foundation for a new cheminformatics toolkit.
Everything you ever wanted to know about tetrahedral stereo SMILES but were afraid to ask.
A critical look at the industry-standard approach to bonding, and an alternative.
A human- and machine readable blueprint for a popular cheminformatics language.
How to avoid a hydrogen assignment free-for-all when reading and writing molfiles.
Cataloging the essential behaviors of molecule-like objects.
Open Source Drug Discovery takes on COVID-19.
Yet another take on a promising, but flawed clinical study.
Thinking differently about an old problem.
Using graphs in machine learning.
A comprehensive tutorial with working demos.
Bridging the divide between reactions and molecules in cheminformatics.
A new library for applied graph theory.
Untangling one of SMILES' most misunderstood features.
Discussion and code examples for Rust's most popular graph library.
A deep dive for beginners into Rust's most important big idea.
Lots of potential, but not much in the way of cheminformatics libraries or community yet.