<div dir="ltr">Hi Matthias,<div><br></div><div>Thank you for the quick response. </div><div>Below is what prompted after running the "make" command in the root directory of the code.</div><div><br></div><div><div>make -j 4 ARCH=Linux-x86_64 VERSION=mycp ATOM<br>Discovering programs ...<br>make: *** No rule to make target 'ATOM'. Stop.</div></div><div><br></div><div>Note: mycpy is an alias of /home/umar/Downloads/cp2k-2024.2/exe/local/cp2k.psmp and ATOM, from what I understand, means the test to be conducted.</div><div><br></div><div>Best regards,</div><div>Umar</div></div><br><div class="gmail_quote gmail_quote_container"><div dir="ltr" class="gmail_attr">On Tue, Dec 10, 2024 at 9:08 PM Krack Matthias <<a href="mailto:matthias.krack@psi.ch">matthias.krack@psi.ch</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div class="msg-5731419655237827450"> <div lang="en-CH" style="overflow-wrap: break-word;"> <div class="m_-5731419655237827450WordSection1"> <p class="MsoNormal"><span lang="DE-CH" style="font-size:11pt">Hi Umar<u></u><u></u></span></p> <p class="MsoNormal"><span lang="DE-CH" style="font-size:11pt"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt">Just try to run the make command again with the target name “test” appended, e.g.<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt">make -j16 ARCH=<arch name> VERSION=psmp test<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt">(see <a href="https://www.cp2k.org/dev:regtesting" target="_blank">https://www.cp2k.org/dev:regtesting</a>)<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt">Best<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt">Matthias<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-US" style="font-size:11pt"><u></u> <u></u></span></p> <div style="border-right:none;border-bottom:none;border-left:none;border-top:1pt solid rgb(181,196,223);padding:3pt 0cm 0cm"> <p class="MsoNormal" style="margin-left:36pt"><b><span style="font-family:Calibri,sans-serif;color:black">From: </span></b><span style="font-family:Calibri,sans-serif;color:black">"<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>" <<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>> on behalf of Umar Yahaya <<a href="mailto:umaryahaya996@gmail.com" target="_blank">umaryahaya996@gmail.com</a>><br> <b>Reply to: </b>"<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>" <<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>><br> <b>Date: </b>Tuesday, 10 December 2024 at 14:54<br> <b>To: </b>"<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>" <<a href="mailto:cp2k@googlegroups.com" target="_blank">cp2k@googlegroups.com</a>><br> <b>Subject: </b>[CP2K:20958] Running CP2K Regression Tests<u></u><u></u></span></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">Dear CP2K Users,<u></u><u></u></p> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">I installed the cp2k-2024.2 version and now I am trying to do some regression tests but I am not sure how to go about it.<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">Am I to navigate to the cp2k/tests directory for the test or do I have to copy the whole directory somewhere in my system? I can see many files together with do_regtest.py in that folder.<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">When I run "python do_regtest.py -h" from my terminal in that directory this prompt:<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-right:0cm;margin-bottom:12pt;margin-left:36pt"> /Downloads/cp2k-2024.2/tests$ python do_regtest.py -h<br> usage: do_regtest.py [-h] [--mpiranks MPIRANKS] [--ompthreads OMPTHREADS]<br> [--maxtasks MAXTASKS] [--num_gpus NUM_GPUS]<br> [--timeout TIMEOUT] [--maxerrors MAXERRORS]<br> [--mpiexec MPIEXEC] [--smoketest] [--valgrind]<br> [--keepalive] [--flagslow] [--debug]<br> [--restrictdir RESTRICTDIR] [--skipdir SKIPDIR]<br> [--workbasedir WORKBASEDIR] [--skip_unittests]<br> [--skip_regtests]<br> arch version<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">I do not understand how to run the tests on the cp2k website.<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><u></u> <u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt">Thank you in anticipating your guidance.<u></u><u></u></p> </div> <div> <p class="MsoNormal" style="margin-left:36pt"><span style="color:rgb(136,136,136)">Umar<u></u><u></u></span></p> </div> </div> <p class="MsoNormal" style="margin-left:36pt">-- <br> You received this message because you are subscribed to the Google Groups "cp2k" group.<br> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+unsubscribe@googlegroups.com" target="_blank">cp2k+unsubscribe@googlegroups.com</a>.<br> To view this discussion visit <a href="https://groups.google.com/d/msgid/cp2k/CAHN%2BkCQ2mbj5uPsFbPuRq1DF28Z%2BPiKr0KyyHLUsFOE-uX77Kw%40mail.gmail.com?utm_medium=email&utm_source=footer" target="_blank"> https://groups.google.com/d/msgid/cp2k/CAHN%2BkCQ2mbj5uPsFbPuRq1DF28Z%2BPiKr0KyyHLUsFOE-uX77Kw%40mail.gmail.com</a>.<br> <br> <u></u><u></u></p> </div> </div> <p></p> -- <br> You received this message because you are subscribed to the Google Groups "cp2k" group.<br> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+unsubscribe@googlegroups.com" target="_blank">cp2k+unsubscribe@googlegroups.com</a>.<br> To view this discussion visit <a href="https://groups.google.com/d/msgid/cp2k/ADC30FBB-7BE4-4981-AC8D-FF48A9443222%40psi.ch?utm_medium=email&utm_source=footer" target="_blank">https://groups.google.com/d/msgid/cp2k/ADC30FBB-7BE4-4981-AC8D-FF48A9443222%40psi.ch</a>.<br> </div></blockquote></div> <p></p> -- <br /> You received this message because you are subscribed to the Google Groups "cp2k" group.<br /> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+unsubscribe@googlegroups.com">cp2k+unsubscribe@googlegroups.com</a>.<br /> To view this discussion visit <a href="https://groups.google.com/d/msgid/cp2k/CAHN%2BkCTVDQzspD4NW1sA46tC_e%3DN-DcRWUn%3DpXa-tXoLQRkV0Q%40mail.gmail.com?utm_medium=email&utm_source=footer">https://groups.google.com/d/msgid/cp2k/CAHN%2BkCTVDQzspD4NW1sA46tC_e%3DN-DcRWUn%3DpXa-tXoLQRkV0Q%40mail.gmail.com</a>.<br />