adding gasteiger charges to peptide
sx:5  sy:3  sz:5  
cx:-18.903  cy:-5.104  cz:11.315  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=rr24btr1r02@student.nitw.ac.in&time=20250305135809&rec=AF-O06299-F1-model_v4.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-03-08 02:19:47 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/544769893@qq.com/bd-screen/20250305172050/screen ../lib/pdbqt/pdbqt7kb_filter 100 null none 4.202 -14.450 13.194 15 6 6 AF-A0A3M6SHF3-F1-model_v4.pdb 544769893@qq.com 1> ../dock_file/544769893@qq.com/bd-screen/20250305172050/screen/log.txt 2>../dock_file/544769893@qq.com/bd-screen/20250305172050/screen/error.txt &')
Error: 未指定口袋参数
php ../php/sendResult_bd.php ../dock_file/rr24btr1r02@student.nitw.ac.in/bd-screen/20250305135809/screen AF-O06299-F1-model_v4.pdb rr24btr1r02@student.nitw.ac.in FDA-approved2025-03-05 13:58:09
2025-03-05 13:58:09

2025-03-05 13:58:09
update status in workRecord success
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