# 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 = "gosh-elastic" version = "0.1.2" authors = ["Wenping Guo "] description = "Elastic Potential Energy" readme = "README.md" license = "GPL-3.0" resolver = "1" [[bench]] name = "trajectory" harness = false [dependencies.gchemol] version = "0.0.42" features = ["adhoc"] [dependencies.gosh-model] version = "0.1" features = ["adhoc"] [dependencies.gut] version = "0.3" package = "gchemol-gut" [dependencies.nxgraph] version = "0.1" features = ["adhoc"] package = "gchemol-graph" [dependencies.serde] version = "1" features = ["derive"] [dependencies.vecfx] version = "0.1" features = [ "nalgebra", "adhoc", ] [dev-dependencies.criterion] version = "0.3" [features] adhoc = []