about summary refs log tree commit diff
path: root/nixpkgs/pkgs/applications/science/chemistry
diff options
context:
space:
mode:
authorAlyssa Ross <hi@alyssa.is>2024-06-23 00:32:22 +0200
committerAlyssa Ross <hi@alyssa.is>2024-06-23 00:32:22 +0200
commit6402b188ddd100b3cd6afe7b8a3e553365203f43 (patch)
tree676b85e4a6ffee092e413e723f7dce8ba01bb48f /nixpkgs/pkgs/applications/science/chemistry
parent5a1826585861b32ce2509c0643e793196d81893e (diff)
parentd603719ec6e294f034936c0d0dc06f689d91b6c3 (diff)
downloadnixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar.gz
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar.bz2
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar.lz
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar.xz
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.tar.zst
nixlib-6402b188ddd100b3cd6afe7b8a3e553365203f43.zip
Merge remote-tracking branch 'nixpkgs/nixos-unstable' HEAD master
Diffstat (limited to 'nixpkgs/pkgs/applications/science/chemistry')
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/element/default.nix2
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/gwyddion/default.nix4
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/jmol/default.nix6
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/marvin/default.nix2
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix4
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/quantum-espresso/default.nix1
-rw-r--r--nixpkgs/pkgs/applications/science/chemistry/siesta/default.nix2
7 files changed, 10 insertions, 11 deletions
diff --git a/nixpkgs/pkgs/applications/science/chemistry/element/default.nix b/nixpkgs/pkgs/applications/science/chemistry/element/default.nix
index c3c4a0fe582e..cc80cb058d92 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/element/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/element/default.nix
@@ -14,7 +14,7 @@ buildGoModule rec {
   vendorHash = "sha256-A4g2rQTaYrA4/0rqldUv7iuibzNINEvx9StUnaN2/Yg=";
 
   meta = with lib; {
-    description = "The periodic table on the command line";
+    description = "Periodic table on the command line";
     mainProgram = "element";
     homepage = "https://github.com/gennaro-tedesco/element";
     license = licenses.asl20;
diff --git a/nixpkgs/pkgs/applications/science/chemistry/gwyddion/default.nix b/nixpkgs/pkgs/applications/science/chemistry/gwyddion/default.nix
index a4b1cd943e1b..c379e432bdeb 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/gwyddion/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/gwyddion/default.nix
@@ -16,10 +16,10 @@
 
 stdenv.mkDerivation rec {
   pname = "gwyddion";
-   version = "2.65";
+   version = "2.66";
   src = fetchurl {
     url = "mirror://sourceforge/gwyddion/gwyddion-${version}.tar.xz";
-    sha256 = "sha256-kRX7CoPJY8YkYNode5g0OCyWmL+5sM8puCmk9ZE2nqM=";
+    sha256 = "sha256-N3vtzSsNjRM6MpaG2p9fkYB/8dR5N/mZEZXx6GN5LVI=";
   };
 
   nativeBuildInputs = [ pkg-config file ];
diff --git a/nixpkgs/pkgs/applications/science/chemistry/jmol/default.nix b/nixpkgs/pkgs/applications/science/chemistry/jmol/default.nix
index bafbeb3529c6..cba6a40b5992 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/jmol/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/jmol/default.nix
@@ -25,14 +25,14 @@ let
   };
 in
 stdenv.mkDerivation rec {
-  version = "16.2.15";
+  version = "16.2.17";
   pname = "jmol";
 
   src = let
     baseVersion = "${lib.versions.major version}.${lib.versions.minor version}";
   in fetchurl {
     url = "mirror://sourceforge/jmol/Jmol/Version%20${baseVersion}/Jmol%20${version}/Jmol-${version}-binary.tar.gz";
-    hash = "sha256-zPHh5IFdttliPc0SCgkM/3UQmS4eT2rfi5HqpFjY5hA=";
+    hash = "sha256-1iBLLfaoztbphhrG3NVWH+PVSbCZd+HQqvCYF3H9S/E=";
   };
 
   patchPhase = ''
@@ -52,7 +52,7 @@ stdenv.mkDerivation rec {
   enableParallelBuilding = true;
 
   meta = with lib; {
-     description = "A Java 3D viewer for chemical structures";
+     description = "Java 3D viewer for chemical structures";
      mainProgram = "jmol";
      homepage = "https://sourceforge.net/projects/jmol";
      sourceProvenance = with sourceTypes; [ binaryBytecode ];
diff --git a/nixpkgs/pkgs/applications/science/chemistry/marvin/default.nix b/nixpkgs/pkgs/applications/science/chemistry/marvin/default.nix
index 090c252bb82c..4228e818e488 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/marvin/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/marvin/default.nix
@@ -39,7 +39,7 @@ stdenv.mkDerivation rec {
   '';
 
   meta = {
-    description = "A chemical modelling, analysis and structure drawing program";
+    description = "Chemical modelling, analysis and structure drawing program";
     homepage = "https://chemaxon.com/products/marvin";
     maintainers = with maintainers; [ fusion809 ];
     license = licenses.unfree;
diff --git a/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix b/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix
index 8ad979473955..d500e78b2482 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix
@@ -43,13 +43,13 @@ let
 in
 stdenv.mkDerivation rec {
   pname = "openmolcas";
-  version = "24.02";
+  version = "24.06";
 
   src = fetchFromGitLab {
     owner = "Molcas";
     repo = "OpenMolcas";
     rev = "v${version}";
-    hash = "sha256-4Ek0cnaRfLEbj1Nj31rRp9b2sois4rIFTcpOUq9h2mw=";
+    hash = "sha256-/y6vEvA1Zf+p7Z0WpcN4P5voLN8MmfbKz1FuthgVQp0=";
   };
 
   patches = [
diff --git a/nixpkgs/pkgs/applications/science/chemistry/quantum-espresso/default.nix b/nixpkgs/pkgs/applications/science/chemistry/quantum-espresso/default.nix
index 4c4482919772..2c565cb5db9f 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/quantum-espresso/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/quantum-espresso/default.nix
@@ -2,7 +2,6 @@
 , stdenv
 , fetchFromGitLab
 , fetchFromGitHub
-, fetchurl
 , git
 , cmake
 , gnum4
diff --git a/nixpkgs/pkgs/applications/science/chemistry/siesta/default.nix b/nixpkgs/pkgs/applications/science/chemistry/siesta/default.nix
index 02586dea2e29..2ec4d37f73ed 100644
--- a/nixpkgs/pkgs/applications/science/chemistry/siesta/default.nix
+++ b/nixpkgs/pkgs/applications/science/chemistry/siesta/default.nix
@@ -63,7 +63,7 @@ stdenv.mkDerivation rec {
   '';
 
   meta = with lib; {
-    description = "A first-principles materials simulation code using DFT";
+    description = "First-principles materials simulation code using DFT";
     mainProgram = "siesta";
     longDescription = ''
          SIESTA is both a method and its computer program