molprint-core 0.1.0

Core molecular graph representation, SMILES parser, and ring perception
Documentation 
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# THIS FILE IS AUTOMATICALLY GENERATED BY CARGO
#
# When uploading crates to the registry Cargo will automatically
# "normalize" Cargo.toml files for maximal compatibility
# with all versions of Cargo and also rewrite `path` dependencies
# to registry (e.g., crates.io) dependencies.
#
# If you are reading this file be aware that the original Cargo.toml
# will likely look very different (and much more reasonable).
# See Cargo.toml.orig for the original contents.

[package]
edition = "2021"
name = "molprint-core"
version = "0.1.0"
authors = ["Marius <marius@molprint.dev>"]
build = false
autolib = false
autobins = false
autoexamples = false
autotests = false
autobenches = false
description = "Core molecular graph representation, SMILES parser, and ring perception"
readme = "README.md"
keywords = [
    "cheminformatics",
    "smiles",
    "molecular",
    "chemistry",
    "graph",
]
categories = [
    "science",
    "algorithms",
]
license = "MIT"
repository = "https://github.com/marius/molprint"

[lib]
name = "molprint_core"
path = "src/lib.rs"

[[bench]]
name = "smiles_parsing"
path = "benches/smiles_parsing.rs"
harness = false

[dependencies.ahash]
version = "0.8"

[dependencies.petgraph]
version = "0.6"

[dependencies.smallvec]
version = "1.13"
features = ["serde"]

[dependencies.thiserror]
version = "2"

[dev-dependencies.criterion]
version = "0.5"
features = ["html_reports"]