adding gasteiger charges to peptide
sx:13.1 sy:21 sz:20.6
cx:-6.8 cy:-5.8 cz:1.4
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one step finished!start thread 0
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../lib/pdbqt/fdaapp_newFDA-approved View result2026-02-16 17:49:07 11
('\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/terina8204@gmail.com/bd-screen/20260213105102/screen ../lib/pdbqt/fdaapp_new 50 null none -46.099 0.950 47.753 13 15 27 GPRC6A_7TM_prepared.pdb terina8204@gmail.com 1> ../dock_file/terina8204@gmail.com/bd-screen/20260213105102/screen/log.txt 2>../dock_file/terina8204@gmail.com/bd-screen/20260213105102/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/amitiitg2011@gmail.com/bd-screen/20260213101438/screen ULDHF.pdb amitiitg2011@gmail.com FDA-approved2026-02-05 12:02:16
2026-02-13 10:14:38
2026-02-11 09:14:32
2026-02-13 10:14:38
2026-02-13 10:14:38
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update status in workRecord success
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