Dear Sir or Madam,
I am trying to install Amber20 with CUDA on a cluster that runs Centos 7.
I managed to install a serial version of Amber 20 and could also build
the CUDA version. However ultimately the installation fails. Here are
the last few lines
-- Installing:
/proj/uucompbiochem/software/amber20/amber20mpi/test//./PIMD/part_nmpimd_water/Run.nmpimd
-- Fixing Miniconda script shebangs
CMake Error at
/proj/uucompbiochem/software/amber20/amber20_src/cmake/FixCondaShebang/FixCondaShebang.cmake:26
(file):
file failed to open for reading (No such file or directory):
/proj/uucompbiochem/software/amber20/amber20mpi//bin/amber.pip
the corresponding location is a dangling symlink. Local support can not
help me, any advise?
Kind regards
Sebastian Brickel
--
Sebastian Brickel,
Postdoctoral research
Department of Chemistry - BMC
Uppsala University
Uppsala, Sweden
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Received on Fri Jun 18 2021 - 03:00:02 PDT
