adding gasteiger charges to peptide
sx:17  sy:30  sz:13  
cx:86.652  cy:-3.918  cz:22.987  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20260522161035&rec=PCNAmove.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-05-23 23:24:06 15
('\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/20260522161143/screen ../lib/pdbqt/fdaapp_new 100 null none 9.661 6.223 20.179 14 10 5 TP53BP1move.pdb 3561937996@qq.com 1> ../dock_file/Guest/bd-screen/20260522161143/screen/log.txt 2>../dock_file/Guest/bd-screen/20260522161143/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20260522161035/screen PCNAmove.pdb 3561937996@qq.com FDA-approved2026-04-23 23:07:16
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update status in workRecord success
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