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resolve "Multiplication result converted to larger type" (#3159)
Mirror to Gitee Repo #1387: Commit 1097062 pushed by wanghan-iapcm
January 20, 2024 14:23 8m 18s devel
January 20, 2024 14:23 8m 18s
docs: document CP2K interface (#3158)
Mirror to Gitee Repo #1386: Commit 4d82430 pushed by wanghan-iapcm
January 20, 2024 14:22 3m 55s devel
January 20, 2024 14:22 3m 55s
cmake: fix setting CMAKE_HIP_FLAGS (#3155)
Mirror to Gitee Repo #1385: Commit 937f03f pushed by wanghan-iapcm
January 20, 2024 14:15 4m 0s devel
January 20, 2024 14:15 4m 0s
move OutOfMemoryError from deepmd to deepmd_utils (#3153)
Mirror to Gitee Repo #1384: Commit efe0962 pushed by wanghan-iapcm
January 20, 2024 14:12 34s devel
January 20, 2024 14:12 34s
docs: update Amber interface (#3074)
Mirror to Gitee Repo #1383: Commit 8c1b467 pushed by njzjz
January 20, 2024 07:31 34s devel
January 20, 2024 07:31 34s
cc: merge DeepPotBase and DeepTensor member functions (#3145)
Mirror to Gitee Repo #1382: Commit d915a91 pushed by wanghan-iapcm
January 18, 2024 01:31 2m 37s devel
January 18, 2024 01:31 2m 37s
fix: some issue of the output def (#3152)
Mirror to Gitee Repo #1381: Commit 5493921 pushed by wanghan-iapcm
January 18, 2024 01:26 33s devel
January 18, 2024 01:26 33s
cc: refactor DataModifier for multiple-backend framework (#3148)
Mirror to Gitee Repo #1380: Commit 1efc7f8 pushed by wanghan-iapcm
January 17, 2024 05:03 4m 10s devel
January 17, 2024 05:03 4m 10s
cc: refactor DeepTensor for multiple-backend framework (#3151)
Mirror to Gitee Repo #1379: Commit 850575a pushed by wanghan-iapcm
January 17, 2024 05:00 37s devel
January 17, 2024 05:00 37s
Mirror to Gitee Repo
Mirror to Gitee Repo #1378: by wanghan-iapcm
January 17, 2024 03:26 1m 4s
January 17, 2024 03:26 1m 4s
[pre-commit.ci] pre-commit autoupdate (#3147)
Mirror to Gitee Repo #1377: Commit 9be1ad2 pushed by wanghan-iapcm
January 17, 2024 03:26 32s devel
January 17, 2024 03:26 32s
resolve "Multiplication result converted to larger type" (#3149)
Mirror to Gitee Repo #1376: Commit ed76cff pushed by wanghan-iapcm
January 17, 2024 01:54 35s devel
January 17, 2024 01:54 35s
Mirror to Gitee Repo
Mirror to Gitee Repo #1375: by pre-commit-ci bot
January 15, 2024 19:43 14m 37s
January 15, 2024 19:43 14m 37s
[pre-commit.ci] pre-commit autoupdate
Mirror to Gitee Repo #1374: Commit 046c7b4 pushed by pre-commit-ci bot
January 15, 2024 19:43 2m 32s pre-commit-ci-update-config
January 15, 2024 19:43 2m 32s
cc: refactor DeepPot to support multiple backends (#3142)
Mirror to Gitee Repo #1373: Commit e218f9c pushed by wanghan-iapcm
January 15, 2024 00:45 50s devel
January 15, 2024 00:45 50s
move deepmd.entrypoints.{doc,gui} to deepmd_utils.entrypoints.{doc,gu…
Mirror to Gitee Repo #1372: Commit 89d9a88 pushed by wanghan-iapcm
January 14, 2024 05:36 5m 40s devel
January 14, 2024 05:36 5m 40s
add cross-platform AutoBatchSize (#3143)
Mirror to Gitee Repo #1371: Commit 539e4ab pushed by wanghan-iapcm
January 14, 2024 05:34 46s devel
January 14, 2024 05:34 46s
move utility to deepmd_utils (without modifaction) (#3140)
Mirror to Gitee Repo #1370: Commit 2096b80 pushed by wanghan-iapcm
January 13, 2024 12:18 33s devel
January 13, 2024 12:18 33s
refactorize networks, now can be used cross platform (#3141)
Mirror to Gitee Repo #1369: Commit ae90498 pushed by wanghan-iapcm
January 13, 2024 07:04 31s devel
January 13, 2024 07:04 31s
refactorize NativeLayer, interface does not rely on the platform (#3138)
Mirror to Gitee Repo #1368: Commit 15117a0 pushed by wanghan-iapcm
January 13, 2024 06:19 33s devel
January 13, 2024 06:19 33s
[Paddle Backend] Add zinc protein (#3135)
Mirror to Gitee Repo #1367: Commit 4c618d7 pushed by njzjz
January 12, 2024 20:22 32s paddle2
January 12, 2024 20:22 32s
support fitting net (#3137)
Mirror to Gitee Repo #1366: Commit 308f97e pushed by wanghan-iapcm
January 12, 2024 14:04 38s devel
January 12, 2024 14:04 38s
fix: model check assumes __call__ as the forward method (#3136)
Mirror to Gitee Repo #1365: Commit d5590a4 pushed by wanghan-iapcm
January 12, 2024 11:14 31s devel
January 12, 2024 11:14 31s
cc: refactor DeepPotModelDevi, making it framework-independent (#3134)
Mirror to Gitee Repo #1364: Commit 828df66 pushed by wanghan-iapcm
January 12, 2024 04:29 32s devel
January 12, 2024 04:29 32s
lmp: fix evflag initialization (#3133)
Mirror to Gitee Repo #1363: Commit 04f07ef pushed by wanghan-iapcm
January 12, 2024 01:55 38s devel
January 12, 2024 01:55 38s