[gmx-users] Many failed tests in gromacs 4.6.3 installation

2013-09-11 Thread Herbert Georg
Hi there, I have installed a couple of days ago the latest (4.6.3) version of Gromacs, in a 12-core Xeon machine using the latest version (14.0) of the non-comercial Intel C++ compiler for linux. The installation seems to have succeeded, but I ran the latest set of tests available (4.6.1) an

Re: [gmx-users] Many failed tests in gromacs 4.6.3 installation

2013-09-11 Thread Herbert Georg
Now all tests PASSED. Thanks! But the folder that appeared after decompression of the tarball was actually the regressiontests-4.6.2. Regarding the benchmark, I tryied to compile with gcc 4.7, but without success. Then I gave icc a try. But can't recall right now the reason for the compilatio