adding gasteiger charges to peptide
sx:30  sy:25  sz:27  
cx:1.865  cy:-10.808  cz:2.723  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=tangan.yanick@ubuea.cm&time=20250428102427&rec=20.A0A8R1XRA5.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-05-02 05:55:54 73
('\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/20250428172609/screen ../lib/pdbqt/fdaapp_new 100 null none 6.897 5.497 -0.951 30 26 30 D1.pdb 18256002033@163.com 1> ../dock_file/Guest/bd-screen/20250428172609/screen/log.txt 2>../dock_file/Guest/bd-screen/20250428172609/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/tangan.yanick@ubuea.cm/bd-screen/20250428102427/screen 20.A0A8R1XRA5.pdb tangan.yanick@ubuea.cm FDA-approved2025-04-08 09:47:30
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update status in workRecord success
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