adding gasteiger charges to peptide
sx:7  sy:12  sz:8  
cx:-5.251  cy:19.701  cz:-14.392  
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../lib/pdbqt/TCMML_pdbqtTCMML<a href="screenresult_blinddock.php?user=mailadivarekarshonak@gmail.com&time=20250410125316&rec=3d06.pdb&lib=TCMML" target="_blank" class="alert-link text-primary"> View result</a>2025-04-15 15:45:23 99
('\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/tangan.yanick@ubuea.cm/bd-screen/20250410083012/screen ../lib/pdbqt/fdaapp_new 100 null none 10.454 2.528 -12.848 18 11 9 7.A0A8R1TMH9.pdb tangan.yanick@ubuea.cm 1> ../dock_file/tangan.yanick@ubuea.cm/bd-screen/20250410083012/screen/log.txt 2>../dock_file/tangan.yanick@ubuea.cm/bd-screen/20250410083012/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/mailadivarekarshonak@gmail.com/bd-screen/20250410125316/screen 3d06.pdb mailadivarekarshonak@gmail.com TCMML2025-04-04 00:32:39
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2025-04-10 12:53:16
update status in workRecord success
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