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authorMCApollo <34170230+MCApollo@users.noreply.github.com>2019-04-20 20:49:46 -0500
committerMCApollo <34170230+MCApollo@users.noreply.github.com>2019-04-23 20:18:47 -0500
commit12335518ab39608d58370c85ff9f5384ad2aa5f7 (patch)
tree352d81f2a2de3f1252af732080ec0fde38c13b4d /homebrew/gromacs
parenta2b26ad12d4fa12f0273645caf4be6d0b8b71e7c (diff)
Ported in the homebrew-marauder for a hacky update/import system.
TODO: Maybe add a license & fix up messy code.
Diffstat (limited to 'homebrew/gromacs')
-rw-r--r--homebrew/gromacs/.beer34
-rw-r--r--homebrew/gromacs/.make.sh-auto6
-rw-r--r--homebrew/gromacs/_metadata/description1
-rw-r--r--homebrew/gromacs/_metadata/homepage1
-rw-r--r--homebrew/gromacs/_metadata/name1
-rw-r--r--homebrew/gromacs/_metadata/version1
-rwxr-xr-xhomebrew/gromacs/download.sh1
7 files changed, 45 insertions, 0 deletions
diff --git a/homebrew/gromacs/.beer b/homebrew/gromacs/.beer
new file mode 100644
index 000000000..ed71dec70
--- /dev/null
+++ b/homebrew/gromacs/.beer
@@ -0,0 +1,34 @@
+{
+ "name": "Gromacs",
+ "description": "Versatile package for molecular dynamics calculations",
+ "url": "https://ftp.gromacs.org/pub/gromacs/gromacs-2019.1.tar.gz",
+ "mirror": null,
+ "homepage": "http://www.gromacs.org/",
+ "depends": [
+ {
+ "depend": "cmake",
+ "build-depend": true
+ },
+ {
+ "depend": "fftw",
+ "build-depend": false
+ },
+ {
+ "depend": "gsl",
+ "build-depend": false
+ }
+ ],
+ "resource": [],
+ "conflicts": [],
+ "patches": [],
+ "install": [
+ "inreplace \"scripts/CMakeLists.txt\", \"CMAKE_INSTALL_BINDIR\",",
+ "\"CMAKE_INSTALL_DATADIR\"",
+ "mkdir \"build\" do",
+ "system \"cmake\", \"..\", *std_cmake_args, \"-DGMX_GSL=ON\"",
+ "system \"make\"",
+ "ENV.deparallelize { system \"make\", \"install\" }"
+ ],
+ "version": "2019.1",
+ "file": "gromacs.rb"
+} \ No newline at end of file
diff --git a/homebrew/gromacs/.make.sh-auto b/homebrew/gromacs/.make.sh-auto
new file mode 100644
index 000000000..9f77f0148
--- /dev/null
+++ b/homebrew/gromacs/.make.sh-auto
@@ -0,0 +1,6 @@
+pkg:setup
+inreplace "scripts/CMakeLists.txt", "CMAKE_INSTALL_BINDIR", "CMAKE_INSTALL_DATADIR"
+mkdir "build" && cd build
+cmake .. -DCMAKE_TOOLCHAIN_FILE=${CMAKE_TOOLCHAIN_FILE} -DGMX_GSL=ON
+make
+ENV.deparallelize { system "make", "install" }
diff --git a/homebrew/gromacs/_metadata/description b/homebrew/gromacs/_metadata/description
new file mode 100644
index 000000000..75fef3376
--- /dev/null
+++ b/homebrew/gromacs/_metadata/description
@@ -0,0 +1 @@
+Versatile package for molecular dynamics calculations
diff --git a/homebrew/gromacs/_metadata/homepage b/homebrew/gromacs/_metadata/homepage
new file mode 100644
index 000000000..ee6b605c6
--- /dev/null
+++ b/homebrew/gromacs/_metadata/homepage
@@ -0,0 +1 @@
+http://www.gromacs.org/
diff --git a/homebrew/gromacs/_metadata/name b/homebrew/gromacs/_metadata/name
new file mode 100644
index 000000000..959897e1e
--- /dev/null
+++ b/homebrew/gromacs/_metadata/name
@@ -0,0 +1 @@
+Gromacs
diff --git a/homebrew/gromacs/_metadata/version b/homebrew/gromacs/_metadata/version
new file mode 100644
index 000000000..1002bd3d9
--- /dev/null
+++ b/homebrew/gromacs/_metadata/version
@@ -0,0 +1 @@
+2019.1
diff --git a/homebrew/gromacs/download.sh b/homebrew/gromacs/download.sh
new file mode 100755
index 000000000..75340fd31
--- /dev/null
+++ b/homebrew/gromacs/download.sh
@@ -0,0 +1 @@
+wget https://ftp.gromacs.org/pub/gromacs/gromacs-2019.1.tar.gz \ No newline at end of file