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update links and hashes for new plumed2 releases

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This commit is contained in:
Axel Kohlmeyer
2023-03-13 12:10:14 -04:00
parent 7b07fe04c8
commit 21293f1c08
20 changed files with 25 additions and 23 deletions
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4
cmake/Modules/Packages/PLUMED.cmake
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@ -54,8 +54,8 @@ if(DOWNLOAD_PLUMED)
set(PLUMED_BUILD_BYPRODUCTS "<INSTALL_DIR>/lib/${CMAKE_STATIC_LIBRARY_PREFIX}plumedWrapper${CMAKE_STATIC_LIBRARY_PREFIX}") set(PLUMED_BUILD_BYPRODUCTS "<INSTALL_DIR>/lib/${CMAKE_STATIC_LIBRARY_PREFIX}plumedWrapper${CMAKE_STATIC_LIBRARY_PREFIX}")
endif() endif()
set(PLUMED_URL "https://github.com/plumed/plumed2/releases/download/v2.8.1/plumed-src-2.8.1.tgz" CACHE STRING "URL for PLUMED tarball") set(PLUMED_URL "https://github.com/plumed/plumed2/releases/download/v2.8.2/plumed-src-2.8.2.tgz" CACHE STRING "URL for PLUMED tarball")
set(PLUMED_MD5 "6bfe72ebdae63dc38a9ca27d9b0e08f8" CACHE STRING "MD5 checksum of PLUMED tarball") set(PLUMED_MD5 "599092b6a0aa6fff992612537ad98994" CACHE STRING "MD5 checksum of PLUMED tarball")
mark_as_advanced(PLUMED_URL) mark_as_advanced(PLUMED_URL)
mark_as_advanced(PLUMED_MD5) mark_as_advanced(PLUMED_MD5)

8
lib/plumed/Install.py
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@ -17,17 +17,17 @@ parser = ArgumentParser(prog='Install.py',
# settings # settings
version = "2.8.1" version = "2.8.2"
mode = "static" mode = "static"
# help message # help message
HELP = """ HELP = """
Syntax from src dir: make lib-plumed args="-b" Syntax from src dir: make lib-plumed args="-b"
or: make lib-plumed args="-b -v 2.4.3" or: make lib-plumed args="-b -v 2.8.2"
or: make lib-plumed args="-p /usr/local/plumed2 -m shared" or: make lib-plumed args="-p /usr/local/plumed2 -m shared"
Syntax from lib dir: python Install.py -b -v 2.4.3 Syntax from lib dir: python Install.py -b -v 2.8.2
or: python Install.py -b or: python Install.py -b
or: python Install.py -p /usr/local/plumed2 -m shared or: python Install.py -p /usr/local/plumed2 -m shared
@ -59,8 +59,10 @@ checksums = { \
'2.7.3' : 'f00cc82edfefe6bb3df934911dbe32fb', \ '2.7.3' : 'f00cc82edfefe6bb3df934911dbe32fb', \
'2.7.4' : 'f858e0b6aed173748fc85b6bc8a9dcb3', \ '2.7.4' : 'f858e0b6aed173748fc85b6bc8a9dcb3', \
'2.7.5' : '2aca1986d6c1ca3ba7e9eb51b1102792', \ '2.7.5' : '2aca1986d6c1ca3ba7e9eb51b1102792', \
'2.7.6' : 'fb8c0ec10f97a9353eb123a5c4c35aa6', \
'2.8.0' : '489b23daba70da78cf0506cbc31689c6', \ '2.8.0' : '489b23daba70da78cf0506cbc31689c6', \
'2.8.1' : '6bfe72ebdae63dc38a9ca27d9b0e08f8', \ '2.8.1' : '6bfe72ebdae63dc38a9ca27d9b0e08f8', \
'2.8.2' : '599092b6a0aa6fff992612537ad98994', \
} }
# parse and process arguments # parse and process arguments

2
tools/singularity/almalinux9.def
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@ -44,7 +44,7 @@ From: library/almalinux:9
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/centos7.def
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@ -37,7 +37,7 @@ From: library/centos:7
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/centos8.def
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@ -42,7 +42,7 @@ From: centos:8
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/fedora35_mingw.def
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@ -49,7 +49,7 @@ From: fedora:35
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/fedora36_mingw.def
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@ -49,7 +49,7 @@ From: fedora:36
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/rocky8.def
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@ -43,7 +43,7 @@ From: rockylinux/rockylinux:8
# manually install Plumed # manually install Plumed
mkdir plumed mkdir plumed
cd plumed cd plumed
version=2.8.1 version=2.8.2
curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz curl -L -o plumed.tar.gz https://github.com/plumed/plumed2/releases/download/v${version}/plumed-src-${version}.tgz
tar -xzf plumed.tar.gz tar -xzf plumed.tar.gz
cd plumed-${version} cd plumed-${version}

2
tools/singularity/ubuntu18.04.def
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@ -107,7 +107,7 @@ From: ubuntu:18.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu18.04_amd_rocm.def
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@ -136,7 +136,7 @@ From: ubuntu:18.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu18.04_gpu.def
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@ -175,7 +175,7 @@ From: ubuntu:18.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu18.04_intel_opencl.def
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@ -108,7 +108,7 @@ From: ubuntu:18.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu18.04_nvidia.def
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@ -107,7 +107,7 @@ From: nvidia/cuda:11.6.2-devel-ubuntu18.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04.def
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@ -103,7 +103,7 @@ From: ubuntu:20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04_amd_rocm.def
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@ -123,7 +123,7 @@ From: ubuntu:20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04_gpu.def
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@ -161,7 +161,7 @@ From: ubuntu:20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04_intel_opencl.def
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@ -101,7 +101,7 @@ From: ubuntu:20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04_nvidia.def
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@ -103,7 +103,7 @@ From: nvidia/cuda:11.6.2-devel-ubuntu20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu20.04_oneapi.def
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@ -140,7 +140,7 @@ From: ubuntu:20.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed

2
tools/singularity/ubuntu22.04.def
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@ -103,7 +103,7 @@ From: ubuntu:22.04
# Plumed # Plumed
########################################################################### ###########################################################################
export PLUMED_PKG_VERSION=2.8.1 export PLUMED_PKG_VERSION=2.8.2
mkdir plumed mkdir plumed
cd plumed cd plumed