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[package]
edition = "2021"
name = "chemrust-nasl-app"
version = "0.1.2"
authors = ["TonyWu20"]
description = "New Adsorption Site Locator (NASL) for catalyst materials. Written in rust. Part of the `chemrust` toolchain. This is the binary crate."
homepage = "https://github.com/TonyWu20/chemrust-nasl"
readme = "README.md"
keywords = [
    "chemistry",
    "chemistry_research",
    "catalysis_research",
    "geometry",
]
license = "MIT"
repository = "https://github.com/TonyWu20/chemrust-nasl"

[dependencies.castep-cell-io]
version = "0.2.4"

[dependencies.castep-periodic-table]
version = "0.5.1"

[dependencies.chemrust-core]
version = "0.3.5"

[dependencies.chemrust-nasl]
version = "0.1.1"

[dependencies.clap]
version = "4"
features = ["derive"]

[dependencies.inquire]
version = "0.7.5"

[dependencies.nalgebra]
version = "0.33"

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

[dependencies.serde_yaml]
version = "0.9.34"