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{lib,vis}[GCCcore/12.3.0,foss/2023a] VMD v1.9.4a57, ACTC v1.1 #22181

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{lib,vis}[GCCcore/12.3.0,foss/2023a] VMD v1.9.4a57, ACTC v1.1 #22181

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Updated software ACTC-1.1-GCCcore-12.3.0.eb

Diff against ACTC-1.1-GCCcore-11.3.0.eb

easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-11.3.0.eb

diff --git a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-11.3.0.eb b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
index 12bca02e2a..76a429b96c 100644
--- a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-11.3.0.eb
+++ b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
@@ -6,14 +6,14 @@ version = '1.1'
 homepage = 'https://sourceforge.net/projects/actc'
 description = "ACTC converts independent triangles into triangle strips or fans."
 
-toolchain = {'name': 'GCCcore', 'version': '11.3.0'}
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
 toolchainopts = {'pic': True}
 
 source_urls = [SOURCEFORGE_SOURCE]
 sources = [SOURCELOWER_TAR_GZ]
 checksums = ['3a1303291629b9de6008c3c9d7b020a4b854802408fb3f8222ec492808c8b44d']
 
-builddependencies = [('binutils', '2.38')]
+builddependencies = [('binutils', '2.40')]
 
 buildopts = 'CC="$CC" CFLAGS="$CFLAGS"'
Diff against ACTC-1.1-GCCcore-10.2.0.eb

easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-10.2.0.eb

diff --git a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-10.2.0.eb b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
index 89ab6d27b0..76a429b96c 100644
--- a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-10.2.0.eb
+++ b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
@@ -1,6 +1,3 @@
-##
-# Author:    Robert Mijakovic <[email protected]>
-##
 easyblock = 'MakeCp'
 
 name = 'ACTC'
@@ -9,14 +6,14 @@ version = '1.1'
 homepage = 'https://sourceforge.net/projects/actc'
 description = "ACTC converts independent triangles into triangle strips or fans."
 
-toolchain = {'name': 'GCCcore', 'version': '10.2.0'}
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
 toolchainopts = {'pic': True}
 
 source_urls = [SOURCEFORGE_SOURCE]
 sources = [SOURCELOWER_TAR_GZ]
 checksums = ['3a1303291629b9de6008c3c9d7b020a4b854802408fb3f8222ec492808c8b44d']
 
-builddependencies = [('binutils', '2.35')]
+builddependencies = [('binutils', '2.40')]
 
 buildopts = 'CC="$CC" CFLAGS="$CFLAGS"'
Diff against ACTC-1.1-GCCcore-9.3.0.eb

easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-9.3.0.eb

diff --git a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-9.3.0.eb b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
index 70fd0130ae..76a429b96c 100644
--- a/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-9.3.0.eb
+++ b/easybuild/easyconfigs/a/ACTC/ACTC-1.1-GCCcore-12.3.0.eb
@@ -6,14 +6,14 @@ version = '1.1'
 homepage = 'https://sourceforge.net/projects/actc'
 description = "ACTC converts independent triangles into triangle strips or fans."
 
-toolchain = {'name': 'GCCcore', 'version': '9.3.0'}
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
 toolchainopts = {'pic': True}
 
 source_urls = [SOURCEFORGE_SOURCE]
 sources = [SOURCELOWER_TAR_GZ]
 checksums = ['3a1303291629b9de6008c3c9d7b020a4b854802408fb3f8222ec492808c8b44d']
 
-builddependencies = [('binutils', '2.34')]
+builddependencies = [('binutils', '2.40')]
 
 buildopts = 'CC="$CC" CFLAGS="$CFLAGS"'

Updated software VMD-1.9.4a57-foss-2023a.eb

Diff against VMD-1.9.4a57-foss-2022a.eb

easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2022a.eb

diff --git a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2022a.eb b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
index 791a53cb6f..ac342c633a 100644
--- a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2022a.eb
+++ b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
@@ -5,7 +5,7 @@ homepage = 'https://www.ks.uiuc.edu/Research/vmd'
 description = """VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular
  systems using 3-D graphics and built-in scripting."""
 
-toolchain = {'name': 'foss', 'version': '2022a'}
+toolchain = {'name': 'foss', 'version': '2023a'}
 
 source_urls = [
     'https://www.ks.uiuc.edu/Research/vmd/vmd-1.9.4/files/alpha/',
@@ -38,19 +38,19 @@ checksums = [
 ]
 
 dependencies = [
-    ('Tcl', '8.6.12'),
-    ('Tk', '8.6.12'),
+    ('Tcl', '8.6.13'),
+    ('Tk', '8.6.13'),
     ('FLTK', '1.3.8'),
-    ('Python', '3.10.4'),
-    ('SciPy-bundle', '2022.05'),
+    ('Python', '3.11.3'),
+    ('SciPy-bundle', '2023.07'),
     ('Tkinter', '%(pyver)s'),
-    ('Mesa', '22.0.3'),
-    ('netCDF', '4.9.0'),
-    ('FFmpeg', '4.4.2'),
-    ('ImageMagick', '7.1.0-37'),
-    ('ACTC', '1.1'),
-    ('zlib', '1.2.12'),
-    ('libpng', '1.6.37'),
+    ('Mesa', '23.1.4'),
+    ('netCDF', '4.9.2'),
+    ('FFmpeg', '6.0'),
+    ('ImageMagick', '7.1.1-15'),
+    ('ACTC', '1.1'),  # Needs New EC
+    ('zlib', '1.2.13'),
+    ('libpng', '1.6.39'),
     ('POV-Ray', '3.7.0.10'),
 ]
Diff against VMD-1.9.4a51-fosscuda-2020b.eb

easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-fosscuda-2020b.eb

diff --git a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-fosscuda-2020b.eb b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
index 6a7845eece..ac342c633a 100644
--- a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-fosscuda-2020b.eb
+++ b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
@@ -1,19 +1,16 @@
-##
-# Author:    Robert Mijakovic <[email protected]>
-##
 name = 'VMD'
-version = '1.9.4a51'
+version = '1.9.4a57'
 
 homepage = 'https://www.ks.uiuc.edu/Research/vmd'
 description = """VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular
  systems using 3-D graphics and built-in scripting."""
 
-toolchain = {'name': 'fosscuda', 'version': '2020b'}
+toolchain = {'name': 'foss', 'version': '2023a'}
 
 source_urls = [
     'https://www.ks.uiuc.edu/Research/vmd/vmd-1.9.4/files/alpha/',
     'https://www.ks.uiuc.edu/Research/vmd/vmd-%(version)s/files/final',
-    'http://webclu.bio.wzw.tum.de/stride/'
+    'http://webclu.bio.wzw.tum.de/stride/'  # bad SSL cert
 ]
 sources = [
     'vmd-%(version)s.src.tar.gz',
@@ -26,36 +23,35 @@ patches = [
     ('VMD-1.9.3_stride_Makefile.patch', 'vmd-%(version)s'),
     ('VMD-1.9.3_stride_MAX_AT_IN_RES.patch', 'vmd-%(version)s'),
     ('VMD-%(version)s_configure.patch', 'vmd-%(version)s'),
-    ('VMD-%(version)s_extra_colors.patch', 'vmd-%(version)s'),
+    ('VMD-1.9.4a51_extra_colors.patch', 'vmd-%(version)s'),
 ]
 checksums = [
-    'b1c40b21111f5bab56d43d5e442c468d327159b07915af2ec175ba6b12842e5c',  # vmd-1.9.4a51.src.tar.gz
+    'de278d0c5d969336d89068e0806fb50aaa0cb0f546ba985d840b279357860679',  # vmd-1.9.4a57.src.tar.gz
     '51a8bc2988bb184bd08216124f61725225bb1a6f563bdf8cd35154cb5d621c1a',  # stride.tar.gz
     '85760d6ae838e2b09801e34b36b484532383f7aaf2e8634b3ef808002a92baa3',  # VMD-1.9.3_plugins.patch
     'd5cfa88064b7cffbc75accd69707d4e45fda974e8127de9ab606fdad501bd68a',  # VMD-1.9.3_surf_Makefile.patch
     'f3c2a8c155e38db8e644cee6a01f6beaea5988e72ac74cde26b71670b151cc34',  # VMD-1.9.3_surf_bad_printfs.patch
     'eb194ac0d8c086b73f87b29f7d732687f902431b1cdfa139c090401fefdee51e',  # VMD-1.9.3_stride_Makefile.patch
     'eff1ca00cec637a6c8a156b2fb038e078d1835ba0eb15a571ed820bca5a866d9',  # VMD-1.9.3_stride_MAX_AT_IN_RES.patch
-    'dc9fc419e2e938f42d2e4784b0c9c7429317893f08d3ed170f949c3ee3aec062',  # VMD-1.9.4a51_configure.patch
+    '231b55bcc2e9e71a0934b2693b56170be4d922a9afe98f39b583617533ef1349',  # VMD-1.9.4a57_configure.patch
     '253eba282b570eb00e4764f46f77fd5ca898d10360d5707dd50ad1f14615af80',  # VMD-1.9.4a51_extra_colors.patch
 ]
 
 dependencies = [
-    ('Tcl', '8.6.10'),
-    ('Tk', '8.6.10'),
-    ('FLTK', '1.3.5'),
-    ('Python', '3.8.6'),
-    ('SciPy-bundle', '2020.11'),
+    ('Tcl', '8.6.13'),
+    ('Tk', '8.6.13'),
+    ('FLTK', '1.3.8'),
+    ('Python', '3.11.3'),
+    ('SciPy-bundle', '2023.07'),
     ('Tkinter', '%(pyver)s'),
-    ('Mesa', '20.2.1'),
-    ('netCDF', '4.7.4'),
-    ('FFmpeg', '4.3.1'),
-    ('ImageMagick', '7.0.10-35'),
-    ('ACTC', '1.1'),
-    ('OptiX', '6.5.0', '', SYSTEM),
-    ('zlib', '1.2.11'),
-    ('libpng', '1.6.37'),
-    ('POV-Ray', '3.7.0.8'),
+    ('Mesa', '23.1.4'),
+    ('netCDF', '4.9.2'),
+    ('FFmpeg', '6.0'),
+    ('ImageMagick', '7.1.1-15'),
+    ('ACTC', '1.1'),  # Needs New EC
+    ('zlib', '1.2.13'),
+    ('libpng', '1.6.39'),
+    ('POV-Ray', '3.7.0.10'),
 ]
 
 moduleclass = 'vis'
Diff against VMD-1.9.4a51-foss-2020b.eb

easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-foss-2020b.eb

diff --git a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-foss-2020b.eb b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
index b170a6dc5f..ac342c633a 100644
--- a/easybuild/easyconfigs/v/VMD/VMD-1.9.4a51-foss-2020b.eb
+++ b/easybuild/easyconfigs/v/VMD/VMD-1.9.4a57-foss-2023a.eb
@@ -1,19 +1,16 @@
-##
-# Author:    Robert Mijakovic <[email protected]>
-##
 name = 'VMD'
-version = '1.9.4a51'
+version = '1.9.4a57'
 
 homepage = 'https://www.ks.uiuc.edu/Research/vmd'
 description = """VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular
  systems using 3-D graphics and built-in scripting."""
 
-toolchain = {'name': 'foss', 'version': '2020b'}
+toolchain = {'name': 'foss', 'version': '2023a'}
 
 source_urls = [
     'https://www.ks.uiuc.edu/Research/vmd/vmd-1.9.4/files/alpha/',
     'https://www.ks.uiuc.edu/Research/vmd/vmd-%(version)s/files/final',
-    'http://webclu.bio.wzw.tum.de/stride/'
+    'http://webclu.bio.wzw.tum.de/stride/'  # bad SSL cert
 ]
 sources = [
     'vmd-%(version)s.src.tar.gz',
@@ -26,35 +23,35 @@ patches = [
     ('VMD-1.9.3_stride_Makefile.patch', 'vmd-%(version)s'),
     ('VMD-1.9.3_stride_MAX_AT_IN_RES.patch', 'vmd-%(version)s'),
     ('VMD-%(version)s_configure.patch', 'vmd-%(version)s'),
-    ('VMD-%(version)s_extra_colors.patch', 'vmd-%(version)s'),
+    ('VMD-1.9.4a51_extra_colors.patch', 'vmd-%(version)s'),
 ]
 checksums = [
-    'b1c40b21111f5bab56d43d5e442c468d327159b07915af2ec175ba6b12842e5c',  # vmd-1.9.4a51.src.tar.gz
+    'de278d0c5d969336d89068e0806fb50aaa0cb0f546ba985d840b279357860679',  # vmd-1.9.4a57.src.tar.gz
     '51a8bc2988bb184bd08216124f61725225bb1a6f563bdf8cd35154cb5d621c1a',  # stride.tar.gz
     '85760d6ae838e2b09801e34b36b484532383f7aaf2e8634b3ef808002a92baa3',  # VMD-1.9.3_plugins.patch
     'd5cfa88064b7cffbc75accd69707d4e45fda974e8127de9ab606fdad501bd68a',  # VMD-1.9.3_surf_Makefile.patch
     'f3c2a8c155e38db8e644cee6a01f6beaea5988e72ac74cde26b71670b151cc34',  # VMD-1.9.3_surf_bad_printfs.patch
     'eb194ac0d8c086b73f87b29f7d732687f902431b1cdfa139c090401fefdee51e',  # VMD-1.9.3_stride_Makefile.patch
     'eff1ca00cec637a6c8a156b2fb038e078d1835ba0eb15a571ed820bca5a866d9',  # VMD-1.9.3_stride_MAX_AT_IN_RES.patch
-    'dc9fc419e2e938f42d2e4784b0c9c7429317893f08d3ed170f949c3ee3aec062',  # VMD-1.9.4a51_configure.patch
+    '231b55bcc2e9e71a0934b2693b56170be4d922a9afe98f39b583617533ef1349',  # VMD-1.9.4a57_configure.patch
     '253eba282b570eb00e4764f46f77fd5ca898d10360d5707dd50ad1f14615af80',  # VMD-1.9.4a51_extra_colors.patch
 ]
 
 dependencies = [
-    ('Tcl', '8.6.10'),
-    ('Tk', '8.6.10'),
-    ('FLTK', '1.3.5'),
-    ('Python', '3.8.6'),
-    ('SciPy-bundle', '2020.11'),
+    ('Tcl', '8.6.13'),
+    ('Tk', '8.6.13'),
+    ('FLTK', '1.3.8'),
+    ('Python', '3.11.3'),
+    ('SciPy-bundle', '2023.07'),
     ('Tkinter', '%(pyver)s'),
-    ('Mesa', '20.2.1'),
-    ('netCDF', '4.7.4'),
-    ('FFmpeg', '4.3.1'),
-    ('ImageMagick', '7.0.10-35'),
-    ('ACTC', '1.1'),
-    ('zlib', '1.2.11'),
-    ('libpng', '1.6.37'),
-    ('POV-Ray', '3.7.0.8'),
+    ('Mesa', '23.1.4'),
+    ('netCDF', '4.9.2'),
+    ('FFmpeg', '6.0'),
+    ('ImageMagick', '7.1.1-15'),
+    ('ACTC', '1.1'),  # Needs New EC
+    ('zlib', '1.2.13'),
+    ('libpng', '1.6.39'),
+    ('POV-Ray', '3.7.0.10'),
 ]
 
 moduleclass = 'vis'

@WilleBell
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Test report by @WilleBell
SUCCESS
Build succeeded for 2 out of 2 (2 easyconfigs in total)
node611.hydra.os - Linux Rocky Linux 8.10, x86_64, AMD EPYC 9384X 32-Core Processor, Python 3.6.8
See https://gist.github.com/WilleBell/750cb213a1e29eb49232b192cfad20f1 for a full test report.

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