adding gasteiger charges to peptide
sx:10  sy:12  sz:14  
cx:10.194  cy:-0.690  cz:3.750  
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../lib/pdbqt/TCMML_pdbqtTCMML<a href="screenresult_blinddock.php?user=markusvictor8@gmail.com&time=20250402142430&rec=PROTEIN-MODEL.pdb&lib=TCMML" target="_blank" class="alert-link text-primary"> View result</a>2025-04-07 19:27:25 77
('\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/amir.pazhuhan@gmail.com/bd-screen/20250402163031/screen ../lib/pdbqt/fdaapp_new 100 null none 6.072 10.271 10.862 22 12 25 file_result.pdb amir.pazhuhan@gmail.com 1> ../dock_file/amir.pazhuhan@gmail.com/bd-screen/20250402163031/screen/log.txt 2>../dock_file/amir.pazhuhan@gmail.com/bd-screen/20250402163031/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/markusvictor8@gmail.com/bd-screen/20250402142430/screen PROTEIN-MODEL.pdb markusvictor8@gmail.com TCMML2025-04-02 14:24:30
2025-04-02 14:24:30

2025-04-02 14:24:30
update status in workRecord success
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