adding gasteiger charges to peptide
sx:30  sy:24  sz:20  
cx:-29.330  cy:-1.886  cz:22.865  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20240404180411&rec=pcybptypeatpase4.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2024-04-05 07:01:30 -4
开始运行命令： perl ../program/Perlscript_Vina_multithread_blind.pl ../dock_file/Guest/bd-screen/20240404181747/screen ../lib/pdbqt/pdbqt7kb_filter 200 null none 90.738 11.000 36.699 18 21 16 2bl9.pdb kutubashraf116@gmail.com 1> ../dock_file/Guest/bd-screen/20240404181747/screen/log.txt 2>../dock_file/Guest/bd-screen/20240404181747/screen/error.txt &
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20240404180411/screen pcybptypeatpase4.pdb muslahatunnessa@gmail.com FDA-approvedupdate status in workRecord success
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