adding gasteiger charges to peptide
sx:18  sy:26  sz:17  
cx:6.283  cy:-0.667  cz:-12.790  
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one step finished!start thread 0<br>
../lib/pdbqt/TCMML_pdbqtTCMML<a href="screenresult_blinddock.php?user=Guest&time=20250806195449&rec=AF-P55084-F1-model_v4.pdb&lib=TCMML" target="_blank" class="alert-link text-primary"> View result</a>2025-08-07 15:40:33 10
('\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/20250806195711/screen ../lib/pdbqt/TCMML_pdbqt 100 null none -5.062 -8.224 -1.993 13 18 19 AF-P35914-F1-model_v4.pdb 1554845347@qq.com 1> ../dock_file/Guest/bd-screen/20250806195711/screen/log.txt 2>../dock_file/Guest/bd-screen/20250806195711/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20250806195449/screen AF-P55084-F1-model_v4.pdb 1554845347@qq.com TCMML2025-07-08 17:29:08
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