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| author | Phillip Seeber <phillip.seeber@googlemail.com> | 2021-11-12 11:52:30 +0100 |
|---|---|---|
| committer | Phillip Seeber <phillip.seeber@googlemail.com> | 2021-11-12 11:52:30 +0100 |
| commit | c810f7befc3f6642ebeaf68cdc9e9e0c90a42559 (patch) | |
| tree | c26406e7bae464ae1759c4cbca22e20028e93cd5 /pkgs/applications/science/chemistry | |
| parent | 99f1ffa46fb1ee6d6c480fce71c9d2f3cbf62ff2 (diff) | |
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openmolcas: 20.06 -> 20.10
Diffstat (limited to 'pkgs/applications/science/chemistry')
| -rw-r--r-- | pkgs/applications/science/chemistry/openmolcas/default.nix | 10 |
1 files changed, 6 insertions, 4 deletions
diff --git a/pkgs/applications/science/chemistry/openmolcas/default.nix b/pkgs/applications/science/chemistry/openmolcas/default.nix index 3cd99179698..1c320335487 100644 --- a/pkgs/applications/science/chemistry/openmolcas/default.nix +++ b/pkgs/applications/science/chemistry/openmolcas/default.nix @@ -5,9 +5,9 @@ } : let - version = "21.06"; + version = "21.10"; # The tag keeps moving, fix a hash instead - gitLabRev = "dd982ad4bc94dec8ac1e3e99cb6a7dd249ff71de"; + gitLabRev = "117305462bac932106e8e3a0347238b768bcb058"; python = python3.withPackages (ps : with ps; [ six pyparsing ]); @@ -19,7 +19,7 @@ in stdenv.mkDerivation { owner = "Molcas"; repo = "OpenMolcas"; rev = gitLabRev; - sha256 = "07dm73n0s7ckif561yb3s9yqxsv39a73kb9qwny4yp39wdvv52hz"; + sha256 = "sha256-GMi2dsNBog+TmpmP6fhQcp6Z5Bh2LelV//MqLnvRP5c="; }; patches = [ @@ -56,7 +56,9 @@ in stdenv.mkDerivation { "-DOPENBLASROOT=${openblas.dev}" ]; - GAROOT=globalarrays; + preConfigure = '' + export GAROOT=${globalarrays}; + ''; postConfigure = '' # The Makefile will install pymolcas during the build grrr. |