adding gasteiger charges to peptide
sx:11  sy:9  sz:9  
cx:19.249  cy:-15.517  cz:-6.326  
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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=ic528@georgetown.edu&time=20260214010512&rec=7RNS_Apo_Clean.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-02-16 21:06:08 9
('\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/20260216120314/screen ../lib/pdbqt/fdaapp_new 100 null none 5.600 3.075 -6.851 15 16 15 refinedmodel3AgrBalphafoldmodel3.pdb basudhalaha@gmail.com 1> ../dock_file/Guest/bd-screen/20260216120314/screen/log.txt 2>../dock_file/Guest/bd-screen/20260216120314/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/ic528@georgetown.edu/bd-screen/20260214010512/screen 7RNS_Apo_Clean.pdb ic528@georgetown.edu FDA-approved2026-01-30 19:31:12
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update status in workRecord success
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