adding gasteiger charges to peptide
sx:19 sy:14 sz:11
cx:-2.464 cy:-5.537 cz:17.615
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one step finished!start thread 0
../lib/pdbqt/fdaapp_newFDA-approved View result2025-07-02 01:47:38 87
('\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/idrisolaitan2009@yahoo.com/bd-screen/20250701002929/screen ../lib/pdbqt/fdaapp_new 100 null none 157.975 12.065 28.246 20 13 25 protein.pdb idrisolaitan2009@yahoo.com 1> ../dock_file/idrisolaitan2009@yahoo.com/bd-screen/20250701002929/screen/log.txt 2>../dock_file/idrisolaitan2009@yahoo.com/bd-screen/20250701002929/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/1344210408@qq.com/bd-screen/20250630224315/screen AF-Q13443-F1-model_v4.pdb 1344210408@qq.com FDA-approved2025-06-28 02:17:23
2025-06-30 22:43:15
2025-06-30 22:43:15
2025-06-30 22:43:15
2025-06-30 22:43:15
update status in workRecord success
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