sci_form/rings/mod.rs
1//! Smallest Set of Smallest Rings (SSSR) perception and ECFP fingerprints.
2//!
3//! - SSSR: Identifies the fundamental cycle basis of the molecular graph
4//! - ECFP: Extended-Connectivity Fingerprints (Morgan algorithm)
5
6pub mod ecfp;
7pub mod sssr;
8
9pub use ecfp::{compute_ecfp, compute_tanimoto, ECFPFingerprint};
10pub use sssr::{compute_sssr, RingInfo};