adding gasteiger charges to peptide
sx:10  sy:8  sz:5  
cx:108.914  cy:79.543  cz:102.094  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20250526121906&rec=8srrChainCALYREF.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-05-26 20:04:15 69
('\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/20250526170817/screen ../lib/pdbqt/TCMML_pdbqt 100 null none 16.538 -2.766 5.557 7 13 5 3lbj_protein.pdb saravananbioinform@gmail.com 1> ../dock_file/Guest/bd-screen/20250526170817/screen/log.txt 2>../dock_file/Guest/bd-screen/20250526170817/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20250526121906/screen 8srrChainCALYREF.pdb phd202400002109@csjmu.ac.in FDA-approved2025-04-27 20:04:45
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update status in workRecord success
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