adding gasteiger charges to peptide
sx:13  sy:16  sz:14  
cx:1.141  cy:5.545  cz:34.708  
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../lib/pdbqt/pdbqt7kb_filterFDA-experimental<a href="screenresult_blinddock.php?user=zagrichuk@tdmu.edu.ua&time=20250403212358&rec=4duh.pdb&lib=FDA-experimental" target="_blank" class="alert-link text-primary"> View result</a>2025-04-08 18:08:27 100
('\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/mailadivarekarshonak@gmail.com/bd-screen/20250404003239/screen ../lib/pdbqt/fdaapp_new 100 null none -53.719 2.330 -34.204 28 22 25 6lud.pdb mailadivarekarshonak@gmail.com 1> ../dock_file/mailadivarekarshonak@gmail.com/bd-screen/20250404003239/screen/log.txt 2>../dock_file/mailadivarekarshonak@gmail.com/bd-screen/20250404003239/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/zagrichuk@tdmu.edu.ua/bd-screen/20250403212358/screen 4duh.pdb zagrichuk@tdmu.edu.ua FDA-experimental2025-03-30 17:26:31
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2025-04-03 21:23:58

2025-04-03 21:23:58
update status in workRecord success
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