adding gasteiger charges to peptide
sx:26  sy:16  sz:14  
cx:-6.490  cy:10.397  cz:-4.004  
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one step finished!start thread 0<br>
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20250406145347&rec=model3.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-04-10 00:36:06 99
('\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/20250406150206/screen ../lib/pdbqt/TCMML_pdbqt 100 null none -6.490 10.397 -4.004 26 16 14 model3.pdb 2381788291@qq.com 1> ../dock_file/Guest/bd-screen/20250406150206/screen/log.txt 2>../dock_file/Guest/bd-screen/20250406150206/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20250406145347/screen model3.pdb 2381788291@qq.com FDA-approved2025-03-10 20:41:45
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