adding gasteiger charges to peptide
sx:34.9  sy:34.9  sz:34.9  
cx:-5.5  cy:-12  cz:10  
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one step finished!start thread 0<br>
../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=abolhassanbahari@gmail.com&time=20250626170158&rec=AF-P05121-F1-model_v4_signal_peptide_deleted_dockprep_cleaned.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-06-28 00:12:36 98
('\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/xiajianleichina@126.com/bd-screen/20250627063736/screen ../lib/pdbqt/TCMML_pdbqt 500 null none -15.395 -2.934 12.728 12 21 18 7e1q.pdb xiajianleichina@126.com 1> ../dock_file/xiajianleichina@126.com/bd-screen/20250627063736/screen/log.txt 2>../dock_file/xiajianleichina@126.com/bd-screen/20250627063736/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/abolhassanbahari@gmail.com/bd-screen/20250626170158/screen AF-P05121-F1-model_v4_signal_peptide_deleted_dockprep_cleaned.pdb abolhassanbahari@gmail.com FDA-approved2025-06-26 17:01:58
2025-06-26 17:01:58

2025-06-26 17:01:58
update status in workRecord success
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