Hello,
I am a new Amber user.
I have succeeded with installation of amber14 regular variant,
but unfortunately failed to install amber14 with GPU CUDA.
I would appreciate if somebody can send me a set of commands
relevant for amber14 with GPU CUDA installation on my Linux workstation.
Thank you,
Michael
See below the details about my workstation,
and system report about failed installation
I have received an error message
after running the commands:
./config -cuda gnu
make install
shokhen.quant-lnx:~/amber14$ make install
cd AmberTools/src && make install
make[1]: Entering directory `/home/shokhen/amber14/AmberTools/src'
AmberTools14 has no CUDA-enabled components
(cd ../../src && make cuda )
make[2]: Entering directory `/home/shokhen/amber14/src'
make[2]: *** No rule to make target `cuda'. Stop.
make[2]: Leaving directory `/home/shokhen/amber14/src'
make[1]: [cuda] Error 2 (ignored)
make[1]: Leaving directory `/home/shokhen/amber14/AmberTools/src'
==============================================================
/home/shokhen/amber14/src/Makefile not found, or -noamber was set.
This is expected if you do not have Amber14.
==============================================================
*****************************
Michael Shokhen, PhD
Associate Professor
Department of Chemistry
Bar Ilan University,
Ramat Gan, 52900
Israel
email: michael.shokhen.gmail.com
email: shokhen.mail.biu.ac.il
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Received on Tue Dec 30 2014 - 12:00:03 PST
