adding gasteiger charges to peptide
sx:10  sy:11  sz:9  
cx:6.780  cy:-1.155  cz:-1.844  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=ahmedgamal_Soliman@agr.asu.edu.eg&time=20260519195240&rec=OXA-23-79-Q9L4P2-F1-model_v6.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-05-19 22:43:06 14
('\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/ahmedgamal_Soliman@agr.asu.edu.eg/bd-screen/20260519195342/screen ../lib/pdbqt/fdaapp_new 100 null none 11.193 -4.458 4.980 7 11 7 0xa51-222-A0A1U9ZNZ9-F1-model_v6.pdb ahmedgamal_Soliman@agr.asu.edu.eg 1> ../dock_file/ahmedgamal_Soliman@agr.asu.edu.eg/bd-screen/20260519195342/screen/log.txt 2>../dock_file/ahmedgamal_Soliman@agr.asu.edu.eg/bd-screen/20260519195342/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/ahmedgamal_Soliman@agr.asu.edu.eg/bd-screen/20260519195240/screen OXA-23-79-Q9L4P2-F1-model_v6.pdb ahmedgamal_Soliman@agr.asu.edu.eg FDA-approved2026-04-22 22:27:22
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update status in workRecord success
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