adding gasteiger charges to peptide
Sorry, there are no Gasteiger parameters available for atom receptor:A:GLU132:OE2
sx:20  sy:21  sz:25  
cx:59.105  cy:13.918  cz:-77.458  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=Guest&time=20260430090725&rec=5HFUbersih.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-04-30 11:50:47 12
没有可运行的命令

('lines', [])
php ../php/sendResult_bd.php ../dock_file/Guest/bd-screen/20260430090725/screen 5HFUbersih.pdb ihsanul.arief@gmail.com FDA-approved2026-03-31 12:54:08
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update status in workRecord success
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