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Add aux support in ml.py for MLP. Fix jit error when saving ml potential with save_dmff2tf.py OpenMM DMFF Plugin tests. #154: Pull request #154 opened by dingye18
December 17, 2023 09:33 3m 4s dingye18:devel
dingye18:devel
December 17, 2023 09:33 3m 4s
Make HarmonicAngleForce overwrite class/type3. Mirror to Gitee Repo #241: Commit 0be33ff pushed by WangXinyan940
December 13, 2023 02:05 26s devel
devel
December 13, 2023 02:05 26s
Make HarmonicAngleForce overwrite class/type3. DMFF's python tests. #547: Commit 0be33ff pushed by WangXinyan940
December 13, 2023 02:05 3m 55s devel
devel
December 13, 2023 02:05 3m 55s
Make HarmonicAngleForce overwrite class/type3. OpenMM DMFF Plugin tests. #153: Commit 0be33ff pushed by WangXinyan940
December 13, 2023 02:05 2m 59s devel
devel
December 13, 2023 02:05 2m 59s
Add docker image for building the OpenMM Plugin for DMFF OpenMM DMFF Plugin tests. #152: Pull request #153 opened by caic99
December 12, 2023 08:08 2m 40s caic99:master
caic99:master
December 12, 2023 08:08 2m 40s
Add docker image for building the OpenMM Plugin for DMFF DMFF's python tests. #546: Pull request #153 opened by caic99
December 12, 2023 08:08 3m 53s caic99:master
caic99:master
December 12, 2023 08:08 3m 53s
Keep the order of atoms when they are equivalent and have the same na… Mirror to Gitee Repo #240: Commit 4244b59 pushed by WangXinyan940
December 7, 2023 15:19 24s devel
devel
December 7, 2023 15:19 24s
Keep the order of atoms when they are equivalent and have the same na… DMFF's python tests. #545: Commit 4244b59 pushed by WangXinyan940
December 7, 2023 15:19 4m 29s devel
devel
December 7, 2023 15:19 4m 29s
Keep the order of atoms when they are equivalent and have the same na… OpenMM DMFF Plugin tests. #151: Commit 4244b59 pushed by WangXinyan940
December 7, 2023 15:19 3m 11s devel
devel
December 7, 2023 15:19 3m 11s
Add eps when calc box_inv Mirror to Gitee Repo #239: Commit 80eee20 pushed by WangXinyan940
December 7, 2023 13:58 31s devel
devel
December 7, 2023 13:58 31s
Add eps when calc box_inv DMFF's python tests. #544: Commit 80eee20 pushed by WangXinyan940
December 7, 2023 13:58 4m 18s devel
devel
December 7, 2023 13:58 4m 18s
Add eps when calc box_inv OpenMM DMFF Plugin tests. #150: Commit 80eee20 pushed by WangXinyan940
December 7, 2023 13:58 3m 4s devel
devel
December 7, 2023 13:58 3m 4s
Save U_ind to pme_force Mirror to Gitee Repo #238: Commit 7a7a7e8 pushed by WangXinyan940
November 22, 2023 10:04 23s devel
devel
November 22, 2023 10:04 23s
Save U_ind to pme_force OpenMM DMFF Plugin tests. #149: Commit 7a7a7e8 pushed by WangXinyan940
November 22, 2023 10:04 8m 41s devel
devel
November 22, 2023 10:04 8m 41s
Save U_ind to pme_force DMFF's python tests. #543: Commit 7a7a7e8 pushed by WangXinyan940
November 22, 2023 10:04 9m 41s devel
devel
November 22, 2023 10:04 9m 41s
Update classical.py OpenMM DMFF Plugin tests. #148: Commit d11ef9d pushed by WangXinyan940
November 22, 2023 08:39 8m 42s devel
devel
November 22, 2023 08:39 8m 42s
Update classical.py DMFF's python tests. #542: Commit d11ef9d pushed by WangXinyan940
November 22, 2023 08:39 9m 31s devel
devel
November 22, 2023 08:39 9m 31s
Update classical.py Mirror to Gitee Repo #237: Commit d11ef9d pushed by WangXinyan940
November 22, 2023 08:39 24s devel
devel
November 22, 2023 08:39 24s
Mirror to Gitee Repo Mirror to Gitee Repo #236: by WangXinyan940
November 9, 2023 14:32 22s
November 9, 2023 14:32 22s
Merge branch 'devel' DMFF's python tests. #541: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 14:32 12m 1s v1.0.0
v1.0.0
November 9, 2023 14:32 12m 1s
Merge branch 'devel' OpenMM DMFF Plugin tests. #147: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 14:32 8m 45s v1.0.0
v1.0.0
November 9, 2023 14:32 8m 45s
Merge branch 'devel' Mirror to Gitee Repo #235: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 14:32 41s v1.0.0
v1.0.0
November 9, 2023 14:32 41s
Merge branch 'devel' Mirror to Gitee Repo #234: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 06:31 24s master
master
November 9, 2023 06:31 24s
Merge branch 'devel' DMFF's python tests. #540: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 06:31 10m 12s master
master
November 9, 2023 06:31 10m 12s
Merge branch 'devel' OpenMM DMFF Plugin tests. #146: Commit 2978f17 pushed by WangXinyan940
November 9, 2023 06:31 8m 34s master
master
November 9, 2023 06:31 8m 34s