elasticrab 0.1.0

Anisotropic Network Model (ANM) normal-mode analysis: atoms in, frequencies and modes out.
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 = "elasticrab"
version = "0.1.0"
authors = ["Mikael Lund"]
build = false
autolib = false
autobins = false
autoexamples = false
autotests = false
autobenches = false
description = "Anisotropic Network Model (ANM) normal-mode analysis: atoms in, frequencies and modes out."
documentation = "https://docs.rs/elasticrab"
readme = "README.md"
keywords = [
    "normal-modes",
    "anm",
    "elastic-network",
    "biophysics",
    "nma",
]
categories = ["science"]
license = "Apache-2.0"
repository = "https://github.com/mlund/elasticrab"

[package.metadata.docs.rs]
all-features = true

[features]
parallel = [
    "sparse",
    "faer/rayon",
]
sparse = ["dep:faer"]

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

[[example]]
name = "animate_pdb"
path = "examples/animate_pdb.rs"

[[test]]
name = "nolb_rtb"
path = "tests/nolb_rtb.rs"

[[test]]
name = "prody_1ubi"
path = "tests/prody_1ubi.rs"

[[test]]
name = "prody_rtb"
path = "tests/prody_rtb.rs"

[[test]]
name = "sparse"
path = "tests/sparse.rs"

[[bench]]
name = "scaling"
path = "benches/scaling.rs"
harness = false
required-features = ["sparse"]

[dependencies.faer]
version = "0.24"
features = [
    "std",
    "sparse-linalg",
]
optional = true
default-features = false

[dependencies.nalgebra]
version = "0.35"
features = ["std"]
default-features = false

[dev-dependencies.approx]
version = "0.5"

[dev-dependencies.divan]
version = "0.1"