sdfrust 0.6.0

A fast, pure-Rust parser for SDF, MOL2, and XYZ chemical structure files
Documentation 
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//! ML-ready molecular featurization.
//!
//! Provides feature extraction functions for graph neural networks,
//! following OGB (Open Graph Benchmark) conventions.

pub mod ogb;

pub use ogb::{
    OgbAtomFeatures, OgbBondFeatures, ogb_atom_features, ogb_bond_features, ogb_graph_features,
};