Docs.rs

WebAssembly bindings for chematic — use chematic from JavaScript/TypeScript

MCP (Model Context Protocol) server for chematic — AI-agent-ready cheminformatics tools

Smooth Particle Mesh Ewald (SPME) electrostatics: real-space erfc Coulomb, reciprocal-space FFT, periodic boundary conditions — pure Rust

2D molecular structure depiction as SVG: ring templates, wedge/dash stereo bonds, CPK coloring, grid layout — pure-Rust, no C/C++ dependencies

3D coordinate generation, DREIDING force field, velocity Verlet MD, PDB/XYZ I/O, conformer RMSD — pure Rust, WASM-compatible

Pure Rust InChI and InChIKey generation for IUPAC standard organic molecules (WASM-compatible)

high level PING-PONG iroh protocol

Pure-Rust PDF — CJK font embedding (Chinese/Japanese/Korean), OCR text overlay, text extraction, HTML→PDF, page merge/split. WASM-ready, zero C deps.

Molecular descriptors: MW, LogP, TPSA, QED, Gasteiger charges, CIP stereo, Murcko scaffold, tautomers, BRICS fragmentation — pure-Rust

MOL/SDF V2000 and V3000 parser and writer for chematic — pure-Rust RDKit alternative

Userland constructs used at the runtime API boundary of Pax Engine

Shared message structs used by Pax runtimes

SymForge — in-memory code intelligence MCP server for Claude Code, Codex, and Gemini CLI

A fast CLI for e-mail and calendar

ECFP4/6, MACCS 166-bit and topological path fingerprints with Tanimoto/Dice similarity for chematic