adding gasteiger charges to peptide
sx:10  sy:13  sz:13  
cx:29.354  cy:28.270  cz:-3.331  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20260428141044&rec=1ZYJ_Preparado.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-04-29 06:03:32 12
没有可运行的命令

('lines', [])
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20260428141044/screen 1ZYJ_Preparado.pdb rodolfo.abarca@uaem.mx FDA-approved2026-03-30 12:34:56
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update status in workRecord success
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