# 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 = "2024"
rust-version = "1.92"
name = "haddock-runner"
version = "3.0.0"
authors = ["Rodrigo V. Honorato <r.vargashonorato@uu.nl>"]
build = false
exclude = [
    ".*",
    "docs/",
]
autolib = false
autobins = false
autoexamples = false
autotests = false
autobenches = false
description = "Run large scale HADDOCK simulations using multiple input molecules in different scenarios"
readme = "README.md"
keywords = [
    "haddock",
    "molecular-docking",
    "bioinformatics",
    "benchmark",
    "structural-biology",
]
categories = [
    "science",
    "command-line-utilities",
]
license = "Apache-2.0"
repository = "https://github.com/haddocking/haddock-runner"

[[bin]]
name = "haddock-runner"
path = "src/main.rs"

[dependencies.anyhow]
version = "1.0"

[dependencies.chrono]
version = "0.4"

[dependencies.clap]
version = "4.5"
features = ["derive"]

[dependencies.env_logger]
version = "0.11"

[dependencies.indexmap]
version = "2.14.0"
features = ["serde"]

[dependencies.indicatif]
version = "0.18"

[dependencies.itertools]
version = "0.14"

[dependencies.log]
version = "0.4"

[dependencies.md-5]
version = "0.10"

[dependencies.regex]
version = "1.12.3"

[dependencies.serde]
version = "1.0"
features = ["derive"]

[dependencies.serde_json]
version = "1.0"

[dependencies.serde_yaml]
version = "0.9"

[dependencies.tempfile]
version = "3.27.0"

[dependencies.toml]
version = "0.8"

[dev-dependencies.criterion]
version = "0.8"

[profile.release]
opt-level = 3
lto = true
codegen-units = 1
