[package]
name = "polysim-core"
description = "Polymer structure generator and physical property simulator built on BigSMILES"
keywords = ["polymer", "smiles", "bigsmiles", "chemistry", "simulation"]
categories = ["science", "algorithms"]
readme = "../../README.md"
version.workspace = true
edition.workspace = true
license.workspace = true
authors.workspace = true
repository.workspace = true
homepage.workspace = true
[dependencies]
bigsmiles = { workspace = true }
opensmiles = { workspace = true }
thiserror = { workspace = true }
[dev-dependencies]
bigsmiles = { workspace = true }
criterion = { workspace = true }
[[bench]]
name = "homopolymer"
harness = false
[[bench]]
name = "molecular_weight"
harness = false