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add print sel mean and std Test Python #1513: Commit 78eede8 pushed by iProzd
January 18, 2025 03:43 42m 18s 0118_dpa3_test_sel
0118_dpa3_test_sel
January 18, 2025 03:43 42m 18s
Update auto_batch_size.py Test Python #1512: Commit 5702a47 pushed by iProzd
January 18, 2025 03:42 1m 25s 0118_dpa3_test_sel
0118_dpa3_test_sel
January 18, 2025 03:42 1m 25s
modify laynorm Test Python #1511: Commit 961fb76 pushed by iProzd
January 17, 2025 08:36 46m 14s 0117_dpa3_model1_new_layernorm
0117_dpa3_model1_new_layernorm
January 17, 2025 08:36 46m 14s
add layernorm Test Python #1510: Commit 1456920 pushed by iProzd
January 17, 2025 08:29 7m 27s 0117_dpa3_model1_new_layernorm
0117_dpa3_model1_new_layernorm
January 17, 2025 08:29 7m 27s
add input partial charge Test Python #1509: Commit dc7a4b3 pushed by iProzd
January 17, 2025 06:38 42m 2s 0117_charge_eeq
0117_charge_eeq
January 17, 2025 06:38 42m 2s
add input partial charge Test Python #1508: Commit dc7a4b3 pushed by iProzd
January 16, 2025 15:31 42m 56s 0116_charge_model1
0116_charge_model1
January 16, 2025 15:31 42m 56s
Update auto_batch_size.py Test Python #1507: Commit 5702a47 pushed by iProzd
January 16, 2025 14:54 37m 51s 0116_charge_model1
0116_charge_model1
January 16, 2025 14:54 37m 51s
add layernorm Test Python #1506: Commit 1456920 pushed by iProzd
January 16, 2025 14:14 55m 22s 0116_dpa3_model2_layernorm
0116_dpa3_model2_layernorm
January 16, 2025 14:14 55m 22s
add node local attention Test Python #1505: Commit 8926664 pushed by iProzd
January 16, 2025 12:06 1h 6m 51s 0116_dpa3_model2_layernorm
0116_dpa3_model2_layernorm
January 16, 2025 12:06 1h 6m 51s
add node local attention Test Python #1504: Commit 8926664 pushed by iProzd
January 16, 2025 11:53 47m 56s 0116_dpa3_model1_g1attn
0116_dpa3_model1_g1attn
January 16, 2025 11:53 47m 56s
add flex eq Test Python #1503: Commit bc35e33 pushed by iProzd
January 16, 2025 10:48 46m 9s 0116_dpa3_model1_g1attn
0116_dpa3_model1_g1attn
January 16, 2025 10:48 46m 9s
feat(pt): support spin virial Test Python #1502: Commit 8fd9565 pushed by iProzd
January 10, 2025 10:49 44m 15s spin_virial_test
spin_virial_test
January 10, 2025 10:49 44m 15s
chore: align dataset summary output (#4541) Test Python #1501: Commit 9af197c pushed by iProzd
January 9, 2025 15:12 44m 2s spin_virial_test
spin_virial_test
January 9, 2025 15:12 44m 2s
Update auto_batch_size.py Test Python #1500: Commit 5702a47 pushed by iProzd
January 7, 2025 07:03 44m 40s 0103_prob_scp_e1a
0103_prob_scp_e1a
January 7, 2025 07:03 44m 40s
add charge Test Python #1499: Commit cb98f07 pushed by iProzd
January 6, 2025 11:30 40m 19s 0106_binding_loss_charge_tebd
0106_binding_loss_charge_tebd
January 6, 2025 11:30 40m 19s
add share fitting and bias in atomic model Test Python #1498: Commit 07f910e pushed by iProzd
January 6, 2025 09:33 1h 11m 34s 0106_binding_loss_charge_tebd
0106_binding_loss_charge_tebd
January 6, 2025 09:33 1h 11m 34s
add share fitting and bias in atomic model Test Python #1497: Commit 07f910e pushed by iProzd
January 6, 2025 09:32 43m 16s 0106_binding_loss_sharefit
0106_binding_loss_sharefit
January 6, 2025 09:32 43m 16s
New substru dpa2 (#33) Test Python #1496: Commit 048d75f pushed by iProzd
January 6, 2025 07:42 46m 5s 0106_binding_loss_sharefit
0106_binding_loss_sharefit
January 6, 2025 07:42 46m 5s
Merge branch 'dpa3-alpha' into 0103_prob_scp_e1a Test Python #1495: Commit 3feb0f6 pushed by iProzd
January 6, 2025 07:08 44m 52s 0103_prob_scp_e1a
0103_prob_scp_e1a
January 6, 2025 07:08 44m 52s
add huber loss Test Python #1494: Commit 2964c01 pushed by iProzd
January 5, 2025 07:35 44m 40s 0103_prob_scp_e1a
0103_prob_scp_e1a
January 5, 2025 07:35 44m 40s
add flex eq Test Python #1493: Commit bc35e33 pushed by iProzd
January 4, 2025 16:00 1h 9m 22s 0104_dpa3_model1_flex_eqv
0104_dpa3_model1_flex_eqv
January 4, 2025 16:00 1h 9m 22s
Update argcheck.py Test Python #1492: Commit cb579a0 pushed by iProzd
January 4, 2025 14:49 1h 17m 20s 0104_dpa3_model1_flex_eqv
0104_dpa3_model1_flex_eqv
January 4, 2025 14:49 1h 17m 20s
add property from devel branch (#38) Test Python #1491: Commit 930e581 pushed by iProzd
January 4, 2025 14:23 2h 18m 52s 0103_prob_scp_e1a
0103_prob_scp_e1a
January 4, 2025 14:23 2h 18m 52s
add property from devel branch Test Python #1490: Pull request #38 opened by iProzd
January 4, 2025 14:22 1h 46m 11s deepmodeling:dpa3-alpha
deepmodeling:dpa3-alpha
January 4, 2025 14:22 1h 46m 11s
Merge branch 'dpa3-alpha' into 1224_dpa3_alpha_mulg1mess Test Python #1489: Commit 0d2008f pushed by iProzd
January 4, 2025 14:19 1h 40m 52s 1224_dpa3_alpha_mulg1mess
1224_dpa3_alpha_mulg1mess
January 4, 2025 14:19 1h 40m 52s