adding gasteiger charges to peptide
sx:13  sy:18  sz:15  
cx:7.156  cy:-6.141  cz:7.185  
start thread 0<br>
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one step finished!start thread 0<br>
../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20250714164248&rec=AF-Q9I0P4-F1-model_v4.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-07-17 09:03:03 23
('\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/20250714211513/screen ../lib/pdbqt/fdaapp_new 100 null none 118.834 118.646 117.206 19 19 5 9jaq.pdb zenggh.frank2024@gdhfi.com 1> ../dock_file/Guest/bd-screen/20250714211513/screen/log.txt 2>../dock_file/Guest/bd-screen/20250714211513/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20250714164248/screen AF-Q9I0P4-F1-model_v4.pdb ankitpatra3110@gmail.com FDA-approved2025-06-17 12:37:00
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update status in workRecord success
邮件发送成功