root
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8064244f51
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add 临时的复制文件脚本
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2024-01-18 17:59:52 +08:00 |
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root
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b76e113089
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update
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2024-01-18 15:26:06 +08:00 |
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root
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62484f046e
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add update
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2024-01-18 14:44:07 +08:00 |
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root
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eb05ccd960
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update test file
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2024-01-18 14:43:51 +08:00 |
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root
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5ad2d91ed3
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update
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2024-01-18 14:15:02 +08:00 |
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root
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e72ca52bcd
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add record
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2024-01-18 11:36:30 +08:00 |
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root
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cc702c8fec
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add fasta file handle;
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2024-01-18 11:33:36 +08:00 |
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root
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dabb69c1af
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comment 复制修复完成文件到指定文件夹
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2024-01-17 09:41:44 +08:00 |
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root
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349555f5bf
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big update
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2024-01-16 17:35:23 +08:00 |
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root
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504b7b4d5b
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use MAS to search fit sequence
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2024-01-16 15:39:26 +08:00 |
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root
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bcf5445f04
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update
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2024-01-16 15:38:51 +08:00 |
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root
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66062bead7
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add use method
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2024-01-16 14:20:29 +08:00 |
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root
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7113cef7da
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add gpu use
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2024-01-15 11:12:56 +08:00 |
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51e4273b81
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change line 127 pid
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2024-01-15 10:21:18 +08:00 |
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b655127432
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update
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2024-01-15 10:20:53 +08:00 |
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f2ae9423ea
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update
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2024-01-15 10:20:39 +08:00 |
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root
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c088094ab9
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add 全局多进程调用modelbuilder.py
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2024-01-12 16:28:39 +08:00 |
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36020e9e34
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update log info
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2024-01-12 11:27:04 +08:00 |
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52ead0d941
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change split dir
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2024-01-12 11:21:17 +08:00 |
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f7bc06ba67
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fix_loops
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2024-01-12 11:19:56 +08:00 |
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4f3daa855b
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chanage log
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2024-01-12 11:19:30 +08:00 |
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3a9a03e6c7
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change split chain path and modellerfix file path
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2024-01-12 10:52:34 +08:00 |
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ff5343789e
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add argparse
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2024-01-12 10:40:55 +08:00 |
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c241916267
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add no fix situation
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2024-01-12 10:36:29 +08:00 |
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root
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722edbd4fc
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remove comment
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2024-01-12 09:36:26 +08:00 |
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root
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908cb9bcf1
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update PDBAlign
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2024-01-11 18:10:01 +08:00 |
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root
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9b39738e9f
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add
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2024-01-11 18:09:14 +08:00 |
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0495e71a23
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add protein_structure (remove HETATM)
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2024-01-11 16:24:40 +08:00 |
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751f3280c9
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add cleanATOM
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2024-01-11 16:10:44 +08:00 |
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root
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5fa9cae3f2
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add download ipynb
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2024-01-11 14:37:59 +08:00 |
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root
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23a1c7d424
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update readme
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2024-01-11 14:37:37 +08:00 |
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root
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e23905ce84
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加强 log
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2024-01-11 11:04:38 +08:00 |
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root
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660f741274
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change NUM_CORES
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2024-01-10 18:18:31 +08:00 |
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a937bd0334
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update error handle
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2024-01-10 09:47:01 +08:00 |
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|
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fbb1fcf3f4
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update
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2024-01-09 13:18:23 +08:00 |
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root
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a77f7dbb16
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add log
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2024-01-09 10:39:22 +08:00 |
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930acfe247
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update to cwd
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2024-01-09 10:11:43 +08:00 |
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117bbf19c5
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add gen top py script;
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2024-01-09 10:10:31 +08:00 |
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baaf63f83a
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add cores args
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2024-01-09 10:10:10 +08:00 |
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root
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27084ba28d
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singler process, singler gpu
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2024-01-05 15:11:27 +08:00 |
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root
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4de8d3ee88
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assign cpu and gpu
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2024-01-05 14:23:02 +08:00 |
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root
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b44ea7119a
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add
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2024-01-05 14:22:17 +08:00 |
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11a97fb80c
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update to env path
|
2024-01-03 11:17:37 +08:00 |
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4257c2041a
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add test func on python
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2023-12-19 13:48:50 +08:00 |
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e10b2f7d2b
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update
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2023-12-19 13:38:28 +08:00 |
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1d7b177071
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update
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2023-12-19 13:38:09 +08:00 |
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8da4e143c6
|
upate
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2023-12-19 12:58:45 +08:00 |
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root
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4bf039ebd9
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update
|
2023-12-19 12:50:56 +08:00 |
|
root
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08db29c224
|
update gromacs script
|
2023-12-19 12:50:13 +08:00 |
|
root
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0c9b52d01c
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update
|
2023-12-19 11:17:31 +08:00 |
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