globus-labs / mof-generation-at-scale / 15466710926

Builds Branch Commit Type Ran Committer Via Coverage
15466710926 new-aurora-config Merge c1e0b11a3 into 674ad4d68 Pull #210 web-flow github
48.05
15466710364 new-aurora-config Actually use the hostfiles, make them up to 9999 Pull #210 WardLT github
45.96
15448954668 new-aurora-config Flake8 fix Pull #210 WardLT github
45.96
15392390135 main Merge pull request #212 from globus-labs/williamyxl-patch-1 Create cp2k.slurm push web-flow github
48.06
15349328283 main Merge pull request #212 from globus-labs/williamyxl-patch-1 Create cp2k.slurm push web-flow github
48.06
15349323749 williamyxl-patch-1 Merge 0d6fefc2a into 5c8b6b3a6 Pull #212 web-flow github
48.06
15349313566 williamyxl-patch-1 Create cp2k.slurm push web-flow github
48.06
15254053193 main Make template resolution part of process_ligands (#211) * Make template resolution part of process_ligands * Fix the validation tests * Fix the test I broke push web-flow github
48.06
15113131514 main Make template resolution part of process_ligands (#211) * Make template resolution part of process_ligands * Fix the validation tests * Fix the test I broke push web-flow github
48.06
15077357769 main Make template resolution part of process_ligands (#211) * Make template resolution part of process_ligands * Fix the validation tests * Fix the test I broke push web-flow github
48.06
15074912831 offload-post-process.py Fix the test I broke Pull #211 WardLT github
48.33
15071755771 new-aurora-config Updates to PWDFT execution on Aurora Problems with Alvaro's binaries and directory permissions Pull #210 WardLT github
45.96
15070520812 new-aurora-config Switch to using a config file push WardLT github
45.97
15068688450 main Implement multi-node training on Polaris (#208) * Pass correct training node list, do not pin GPUs PyT-L handles GPU pinning itself * Lower port number, fix check for XPU * Update the run file to do DDP properly * Set strategy explicitly * F... push web-flow github
45.97
15068517653 polaris-multi-train Flake8 fixes Pull #208 WardLT github
45.97