{ description = "Calculating open system bath energy changes with HOPS and analytically."; inputs = { nixpkgs.url = "nixpkgs/nixos-unstable"; mach-nix.url = "github:DavHau/mach-nix"; flake-utils.url = "github:numtide/flake-utils"; }; outputs = { self, nixpkgs, flake-utils, mach-nix }: let python = "python39"; pypiDataRev = "master"; pypiDataSha256 = "041rpjrwwa43hap167jy8blnxvpvbfil0ail4y4mar1q5f0q57xx"; devShell = pkgs: pkgs.mkShell { buildInputs = [ (pkgs.${python}.withPackages (ps: with ps; [ black mypy ])) pkgs.nodePackages.pyright ]; }; in flake-utils.lib.eachDefaultSystem (system: let pkgs = nixpkgs.legacyPackages.${system}; mach-nix-wrapper = import mach-nix { inherit pkgs python pypiDataRev pypiDataSha256; }; fcSpline = (mach-nix-wrapper.buildPythonPackage {src = builtins.fetchTarball { url = "https://github.com/cimatosa/fcSpline/archive/4312b2c63d52711bff1bfe282d92f98a3e5073fb.tar.gz"; sha256 = "0l38q5avcbiyqlmmhznw9sg02y54fia6r7x2f9w6h3kqf2xh05yc"; }; pname="fcSpline"; version="0.1"; requirements='' numpy cython setuptools scipy ''; }); stocproc = (mach-nix-wrapper.buildPythonPackage {src = builtins.fetchTarball { url = "https://github.com/vale981/stocproc/archive/c81eead1b86d8da0caa5ec013b5fb65e9d3c3b79.tar.gz"; sha256 = "00fvfmdcpkm9lp2zn8kzzn6msq7cypqhf87ihrf63ci5z4hg2jpl"; }; pname="stocproc"; version = "1.0.1"; requirements = '' numpy cython setuptools mpmath scipy ''; }); requirements = builtins.readFile ./requirements.txt; pythonShell = mach-nix-wrapper.mkPythonShell { requirements = requirements; packagesExtra = [fcSpline stocproc]; _.stocproc.buildInputs.add = [fcSpline]; }; pythonPackage = mach-nix-wrapper.buildPythonPackage ./.; mergeEnvs = envs: pkgs.mkShell (builtins.foldl' (a: v: { buildInputs = a.buildInputs ++ v.buildInputs; nativeBuildInputs = a.nativeBuildInputs ++ v.nativeBuildInputs; }) (pkgs.mkShell { }) envs); in { devShell = mergeEnvs [ (devShell pkgs) pythonShell ]; defaultPackage = pythonPackage; }); }