adding gasteiger charges to peptide
sx:8  sy:7  sz:8  
cx:5.933  cy:-6.828  cz:32.236  
start thread 0<br>
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one step finished!start thread 0<br>
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../lib/pdbqt/TCMML_pdbqtTCMML<a href="screenresult_blinddock.php?user=lx631847851@gmail.com&time=20260526122119&rec=TWIST1.pdb&lib=TCMML" target="_blank" class="alert-link text-primary"> View result</a>2026-05-26 19:08:59 13
('\xe5\xbc\x80\xe5\xa7\x8b\xe8\xbf\x90\xe8\xa1\x8c\xe5\x91\xbd\xe4\xbb\xa4\xef\xbc\x9a', 'perl ../program/Perlscript_Vina_multithread_blind.pl ../dock_file/Guest/bd-screen/20260526160052/screen ../lib/pdbqt/fdaapp_new 100 null none 166.530 183.202 167.676 11 11 14 8EMR_protein.pdb 509081076@qq.com 1> ../dock_file/Guest/bd-screen/20260526160052/screen/log.txt 2>../dock_file/Guest/bd-screen/20260526160052/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/lx631847851@gmail.com/bd-screen/20260526122119/screen TWIST1.pdb lx631847851@gmail.com TCMML2026-05-26 12:18:20
2026-05-26 12:21:19
2026-05-26 12:20:29
2026-05-26 12:21:19
2026-05-26 12:21:19
2026-05-26 12:21:19

2026-05-26 12:21:19
update status in workRecord success
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