adding gasteiger charges to peptide
sx:11  sy:14  sz:12  
cx:11.752  cy:24.257  cz:41.441  
start thread 0<br>
start thread 1<br>
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start thread 10<br>
start thread 11<br>
one step finished!start thread 0<br>
../lib/pdbqt/TCMML_pdbqtTCMML<a href="screenresult_blinddock.php?user=Guest&time=20250802173812&rec=CdnE.pdb&lib=TCMML" target="_blank" class="alert-link text-primary"> View result</a>2025-08-03 07:55:22 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/1344210408@qq.com/bd-screen/20250802210709/screen ../lib/pdbqt/fdaapp_new 100 null none -5.960 3.327 10.052 9 4 6 AF-Q9H2A7-F1-model_v4.pdb 1344210408@qq.com 1> ../dock_file/1344210408@qq.com/bd-screen/20250802210709/screen/log.txt 2>../dock_file/1344210408@qq.com/bd-screen/20250802210709/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20250802173812/screen CdnE.pdb 15001154939@aliyun.com TCMML2025-07-04 15:39:23
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