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Merge origin/master into reactff AutomaticBuild #259: Commit a991adc pushed by conradhuebler
1h 4m 1s master
master
1h 4m 1s
Port GPU plugin loader to Windows/MinGW AutomaticBuild #258: Commit bc3790e pushed by conradhuebler
1h 4m 28s master
master
1h 4m 28s
Fix stb_image_write.h download (tinygltf mirror 404s) AutomaticBuild #257: Commit 70ef2b5 pushed by conradhuebler
29m 56s master
master
29m 56s
Fix ConfScan threaded-reorder stall and reorder-geometry truncation AutomaticBuild #256: Commit 8ad12ce pushed by conradhuebler
2m 40s master
master
2m 40s
Merge branch 'confsearch' AutomaticBuild #255: Commit 9789c71 pushed by conradhuebler
3m 24s master
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Docs: xtb --gfnff segfaults above ~700-800 atoms; no reference exists… AutomaticBuild #254: Commit 1862c5b pushed by conradhuebler
23m 3s master
master
23m 3s
Merge origin/master (MKL BLAS threads fix) AutomaticBuild #253: Commit 002ae98 pushed by conradhuebler
22m 0s master
master
22m 0s
Fix MKL BLAS threads calling-convention crash (GFN-FF EEQ thread) AutomaticBuild #252: Commit 70c0a86 pushed by conradhuebler
1h 3m 3s master
master
1h 3m 3s
Fix GFN-FF S30L torsion residuals 27/28 + 7/8 (torsion params, not fqq) AutomaticBuild #251: Commit 13045d9 pushed by conradhuebler
1h 7m 51s master
master
1h 7m 51s
Add GFN2/GFN1 electronic free-energy (Fermi entropy) term; complex 6.… AutomaticBuild #250: Commit 05f011f pushed by conradhuebler
59m 41s master
master
59m 41s
Fix GFN-FF Hückel: subtract pi-system charge (ipis) from nelpi AutomaticBuild #249: Commit 6981224 pushed by conradhuebler
1h 1m 32s master
master
1h 1m 32s
Fix MSVC link: don't pass raw pthread to curcuma_core/curcuma_cap AutomaticBuild #248: Commit 5eafe7d pushed by conradhuebler
59m 45s master
master
59m 45s
Fix Windows build (MinGW + MSVC): dlfcn.h guard and popen/pclose AutomaticBuild #247: Commit 8a160b5 pushed by conradhuebler
1h 0m 6s master
master
1h 0m 6s
Fix MSVC build: guard __attribute__((optimize)) in rmsd_functions.h; … AutomaticBuild #246: Commit db65386 pushed by conradhuebler
25m 20s master
master
25m 20s
Fix consumer install(): guard curcuma/curcuma_helper installs to stan… AutomaticBuild #245: Commit e787919 pushed by conradhuebler
25m 23s master
master
25m 23s
Fix macOS link: use dlsym instead of weak/weak_import for BLAS symbols AutomaticBuild #244: Commit b5401e8 pushed by conradhuebler
24m 20s master
master
24m 20s
Fix macOS link: use weak_import instead of weak for optional BLAS sym… AutomaticBuild #243: Commit eccd49c pushed by conradhuebler
1h 0m 35s master
master
1h 0m 35s
Fix macOS link: OpenMP flags alone don't link the runtime on Apple Clang AutomaticBuild #242: Commit 84d7cd4 pushed by conradhuebler
1h 4m 1s master
master
1h 4m 1s
Fix MSVC portability: popen, missing include, OpenMP index, UTF-8 AutomaticBuild #241: Commit 7436c15 pushed by conradhuebler
1h 2m 27s master
master
1h 2m 27s
Fix macOS build: add OpenMP include dirs, not just compile flags AutomaticBuild #240: Commit df63675 pushed by conradhuebler
50m 12s master
master
50m 12s
Skip km (Kuhn-Munkres C library) on MSVC: dead code, VLA-incompatible AutomaticBuild #239: Commit 950e355 pushed by conradhuebler
1h 1m 17s master
master
1h 1m 17s
Fix MSVC build: define _USE_MATH_DEFINES project-wide AutomaticBuild #238: Commit a9d8831 pushed by conradhuebler
58m 0s master
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Fix MSVC build: guard unistd.h usage for Windows AutomaticBuild #237: Commit 0740126 pushed by conradhuebler
1h 0m 55s master
master
1h 0m 55s
Merge origin/feature/vulkan_rocm: ROCm/HIP/Vulkan GPU, d-shell xTB, G… AutomaticBuild #236: Commit 75ead29 pushed by conradhuebler
1h 3m 59s master
master
1h 3m 59s
Fix reorder_xyz Kabsch alignment and populate rmsd_raw in JSON output AutomaticBuild #235: Commit 5f9b7d5 pushed by conradhuebler
1h 2m 37s master
master
1h 2m 37s