Building tleap: Difference between revisions
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(Created page with "source /home/wales/ambertools2/amber20_src/amber.sh in ~/ambertools2/amber20_src/AmberTools/src/leap make make install now tleap and teleap are in ~/ambertools2/amber20_src/bin which tleap ~/ambertools2/amber20_src/bin/tleap now it should be possible to do tleap -f leap.in") |
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To start from the tarball : |
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bunzip2 AmberTools20.tar.bz2 |
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tar -xvf AmberTools20.tar |
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cd amber20_src |
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export AMBERHOME=`pwd` |
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If there are missing packages you may need an install: |
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apt-get install csh flex gfortran g++ xorg-dev zlib1g-dev libbz2-dev patch python-tk python-matplotlib |
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To set up the environment variables use |
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source /home/wales/ambertools2/amber20_src/amber.sh |
source /home/wales/ambertools2/amber20_src/amber.sh |
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whichcould go in ~/.bashrc |
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Latest revision as of 14:30, 7 April 2026
To start from the tarball :
bunzip2 AmberTools20.tar.bz2 tar -xvf AmberTools20.tar cd amber20_src
export AMBERHOME=`pwd`
If there are missing packages you may need an install:
apt-get install csh flex gfortran g++ xorg-dev zlib1g-dev libbz2-dev patch python-tk python-matplotlib
To set up the environment variables use
source /home/wales/ambertools2/amber20_src/amber.sh
whichcould go in ~/.bashrc
in ~/ambertools2/amber20_src/AmberTools/src/leap
make make install
now tleap and teleap are in
~/ambertools2/amber20_src/bin
which tleap
~/ambertools2/amber20_src/bin/tleap
now it should be possible to do
tleap -f leap.in