adding gasteiger charges to peptide
sx:17  sy:24  sz:21  
cx:19.334  cy:3.086  cz:-11.854  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=jmanuel.guzman@academicos.udg.mx&time=20250413142525&rec=CNR15u09.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-04-18 19:07:22 95
('\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/caishanlivet@outlook.com/bd-screen/20250414093626/screen ../lib/pdbqt/fdaapp_new 100 null none 6.442 5.505 16.528 23 18 21 S3_AHG25355.1_model2.pdb caishanlivet@outlook.com 1> ../dock_file/caishanlivet@outlook.com/bd-screen/20250414093626/screen/log.txt 2>../dock_file/caishanlivet@outlook.com/bd-screen/20250414093626/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/jmanuel.guzman@academicos.udg.mx/bd-screen/20250413142525/screen CNR15u09.pdb jmanuel.guzman@academicos.udg.mx FDA-approved2025-04-13 14:25:25
2025-04-13 14:25:25
2025-04-13 21:47:24
2025-04-13 14:25:25

2025-04-13 14:25:25
update status in workRecord success
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