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gmx: fix include directive (#3221) Mirror to Gitee Repo #1487: Commit 412c812 pushed by wanghan-iapcm
February 3, 2024 04:39 32s devel
devel
February 3, 2024 04:39 32s
fix bug of output def: the reduced virial is not defined. (#3219) Mirror to Gitee Repo #1486: Commit 677d936 pushed by njzjz
February 2, 2024 21:05 55s devel
devel
February 2, 2024 21:05 55s
fix compile gromacs with precompiled C library (#3217) Mirror to Gitee Repo #1485: Commit 701b913 pushed by wanghan-iapcm
February 2, 2024 06:52 34s devel
devel
February 2, 2024 06:52 34s
feat: breaking: backend indepdent definition for dp model (#3208) Mirror to Gitee Repo #1484: Commit eb9b2ef pushed by wanghan-iapcm
February 2, 2024 06:00 1m 10s devel
devel
February 2, 2024 06:00 1m 10s
pt: add tensorboard and profiler support (#3204) Mirror to Gitee Repo #1483: Commit 032fa7d pushed by wanghan-iapcm
January 31, 2024 14:27 18m 44s devel
devel
January 31, 2024 14:27 18m 44s
pt: set nthreads from env (#3205) Mirror to Gitee Repo #1482: Commit 19a8dfb pushed by wanghan-iapcm
January 31, 2024 14:27 9m 49s devel
devel
January 31, 2024 14:27 9m 49s
Feat: add pair table model to pytorch (#3192) Mirror to Gitee Repo #1481: Commit afb440a pushed by wanghan-iapcm
January 31, 2024 09:20 28s devel
devel
January 31, 2024 09:20 28s
fix GPU test OOM problem (#3207) Mirror to Gitee Repo #1480: Commit d2edb77 pushed by wanghan-iapcm
January 31, 2024 05:15 33s devel
devel
January 31, 2024 05:15 33s
build macos-arm64 wheel on M1 runners (#3206) Mirror to Gitee Repo #1479: Commit 664c70b pushed by wanghan-iapcm
January 31, 2024 01:23 37s devel
devel
January 31, 2024 01:23 37s
Fix GPU UTs (#3203) Mirror to Gitee Repo #1478: Commit 7f069cc pushed by wanghan-iapcm
January 31, 2024 01:06 37s devel
devel
January 31, 2024 01:06 37s
remove duplicated fitting output check. fix codeql (#3202) Mirror to Gitee Repo #1477: Commit b800043 pushed by njzjz
January 30, 2024 08:52 2m 2s devel
devel
January 30, 2024 08:52 2m 2s
breaking: pt: add dp model format and refactor pt impl for the fittin… Mirror to Gitee Repo #1476: Commit c6a6b59 pushed by wanghan-iapcm
January 30, 2024 05:56 4m 32s devel
devel
January 30, 2024 05:56 4m 32s
allow disabling TensorFlow backend during Python installation (#3200) Mirror to Gitee Repo #1475: Commit de18f78 pushed by wanghan-iapcm
January 30, 2024 03:47 4m 28s devel
devel
January 30, 2024 03:47 4m 28s
throw errors when PyTorch CXX11 ABI is different from TensorFlow (#3201) Mirror to Gitee Repo #1474: Commit f9a7fe8 pushed by wanghan-iapcm
January 30, 2024 03:44 30s devel
devel
January 30, 2024 03:44 30s
fix: install CU11 PyTorch in the CU11 docker image (#3198) Mirror to Gitee Repo #1473: Commit 4a29c8c pushed by wanghan-iapcm
January 29, 2024 10:32 6m 0s devel
devel
January 29, 2024 10:32 6m 0s
docs: document PyTorch backend (#3193) Mirror to Gitee Repo #1472: Commit 8eadd3e pushed by wanghan-iapcm
January 29, 2024 10:31 33s devel
devel
January 29, 2024 10:31 33s
breaking: pt: unify the output of descriptors. (#3190) Mirror to Gitee Repo #1471: Commit 1e51a88 pushed by wanghan-iapcm
January 29, 2024 04:20 35s devel
devel
January 29, 2024 04:20 35s
reorganize tests directory (#3196) Mirror to Gitee Repo #1470: Commit 8900561 pushed by njzjz
January 29, 2024 02:13 37s devel
devel
January 29, 2024 02:13 37s
drop tqdm (#3194) Mirror to Gitee Repo #1469: Commit 0bb44f3 pushed by wanghan-iapcm
January 29, 2024 01:24 1m 42s devel
devel
January 29, 2024 01:24 1m 42s
add size and replace arguments to deepmd.utils.random.choice (#3195) Mirror to Gitee Repo #1468: Commit 5b64d5c pushed by wanghan-iapcm
January 29, 2024 00:46 32s devel
devel
January 29, 2024 00:46 32s
PT: keep the same checkpoint behavior as TF (#3191) Mirror to Gitee Repo #1467: Commit a8168b5 pushed by wanghan-iapcm
January 28, 2024 08:38 33s devel
devel
January 28, 2024 08:38 33s
breaking: pt: change the virial output dim to 9 (#3188) Mirror to Gitee Repo #1466: Commit 497c8ba pushed by wanghan-iapcm
January 28, 2024 08:30 32s devel
devel
January 28, 2024 08:30 32s
Fix PT DeepPot and replace ASE calculator (#3186) Mirror to Gitee Repo #1465: Commit 3e4715f pushed by wanghan-iapcm
January 27, 2024 12:23 4m 47s devel
devel
January 27, 2024 12:23 4m 47s
Merge TF and PT CLI (#3187) Mirror to Gitee Repo #1464: Commit 484bdc3 pushed by wanghan-iapcm
January 27, 2024 12:21 29s devel
devel
January 27, 2024 12:21 29s
breaking: drop Python 3.7 support (#3185) Mirror to Gitee Repo #1463: Commit 2631ce2 pushed by wanghan-iapcm
January 27, 2024 10:19 8m 5s devel
devel
January 27, 2024 10:19 8m 5s