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python311Packages.rdkit: 2023.03.3 -> 2023.09.1

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Diff: https://github.com/rdkit/rdkit/compare/Release_2023_03_3...Release_2023_09_1

Changelog: https://github.com/rdkit/rdkit/releases/tag/Release_2023_09_1
This commit is contained in:
natsukium 2023-10-15 00:19:28 +09:00
parent ce2c2b598d
commit d8a844d073
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GPG key ID: 9EA45A31DB994C53
1 changed files with 7 additions and 7 deletions
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14
pkgs/development/python-modules/rdkit/default.nix
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@ -21,16 +21,16 @@
let let
external = { external = {
avalon = fetchFromGitHub { avalon = fetchFromGitHub {
owner = "rohdebe1"; owner = "rdkit";
repo = "ava-formake"; repo = "ava-formake";
rev = "AvalonToolkit_2.0.4a"; rev = "AvalonToolkit_2.0.5-pre.3";
hash = "sha256-ZyhrDBBv9XuXe1NY/Djiad86tGIJwCSTrxEMICHgSqk="; hash = "sha256-2MuFZgRIHXnkV7Nc1da4fa7wDx57VHUtwLthrmjk+5o=";
}; };
yaehmop = fetchFromGitHub { yaehmop = fetchFromGitHub {
owner = "greglandrum"; owner = "greglandrum";
repo = "yaehmop"; repo = "yaehmop";
rev = "v2022.09.1"; rev = "v2023.03.1";
hash = "sha256-QMnc5RyHlY3giw9QmrkGntiA+Srs7OhCIKs9GGo5DfQ="; hash = "sha256-K9//cDN69U4sLETfIZq9NUaBE3RXOReH53qfiCzutqM=";
}; };
freesasa = fetchFromGitHub { freesasa = fetchFromGitHub {
owner = "mittinatten"; owner = "mittinatten";
@ -42,7 +42,7 @@ let
in in
buildPythonPackage rec { buildPythonPackage rec {
pname = "rdkit"; pname = "rdkit";
version = "2023.03.3"; version = "2023.09.1";
format = "other"; format = "other";
src = src =
@ -53,7 +53,7 @@ buildPythonPackage rec {
owner = pname; owner = pname;
repo = pname; repo = pname;
rev = "Release_${versionTag}"; rev = "Release_${versionTag}";
hash = "sha256-5M7nDUWORbepDGaf2G6Cd79Hu0au3DNRc9KuONoCWK0="; hash = "sha256-qaYD/46oCTnso1FbD08zr2JuatKmSSqNBhOYlfeIiAA=";
}; };
unpackPhase = '' unpackPhase = ''