adding gasteiger charges to peptide
sx:12  sy:12  sz:11  
cx:25.506  cy:-6.087  cz:-21.313  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=muhammadrahiyab@gmail.com&time=20250322141957&rec=thymidine.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2025-03-27 02:42:53 99
('\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/muhammadrahiyab@gmail.com/bd-screen/20250322151139/screen ../lib/pdbqt/pdbqt7kb_filter 100 null none 25.506 -6.087 -21.313 12 12 11 thymidine.pdb muhammadrahiyab@gmail.com 1> ../dock_file/muhammadrahiyab@gmail.com/bd-screen/20250322151139/screen/log.txt 2>../dock_file/muhammadrahiyab@gmail.com/bd-screen/20250322151139/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/muhammadrahiyab@gmail.com/bd-screen/20250322141957/screen thymidine.pdb muhammadrahiyab@gmail.com FDA-approved2025-02-15 15:14:05
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2025-03-22 14:19:57
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