adding gasteiger charges to peptide
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=100519969@est.uasd.edu.do&time=20250415200346&rec=WFF71381.1_E_DENV2.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-04-20 11:54:09 94
('\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/100519969@est.uasd.edu.do/bd-screen/20250415220321/screen ../lib/pdbqt/fdaapp_new 100 null none 10 5 0 30 30 30 WFF71377.1_E_DENV2.pdb 100519969@est.uasd.edu.do 1> ../dock_file/100519969@est.uasd.edu.do/bd-screen/20250415220321/screen/log.txt 2>../dock_file/100519969@est.uasd.edu.do/bd-screen/20250415220321/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/100519969@est.uasd.edu.do/bd-screen/20250415200346/screen WFF71381.1_E_DENV2.pdb 100519969@est.uasd.edu.do FDA-approved2025-04-14 22:16:33
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update status in workRecord success
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