adding gasteiger charges to peptide
sx:7  sy:11  sz:7  
cx:11.193  cy:-4.458  cz:4.980  
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../lib/pdbqt/fdaapp_newFDA-approved<a href="screenresult_blinddock.php?user=ahmedgamal_Soliman@agr.asu.edu.eg&time=20260519195342&rec=0xa51-222-A0A1U9ZNZ9-F1-model_v6.pdb&lib=FDA-approved" target="_blank" class="alert-link text-primary"> View result</a>2026-05-20 00:17:35 15
('\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/Guest/bd-screen/20260519185800/screen ../lib/pdbqt/TCMML_pdbqt 100 null none 0.189 -0.110 -5.936 23 28 17 ABCG1.pdb 1359968310@qq.com 1> ../dock_file/Guest/bd-screen/20260519185800/screen/log.txt 2>../dock_file/Guest/bd-screen/20260519185800/screen/error.txt &')
php ../php/sendResult_bd.php ../dock_file/ahmedgamal_Soliman@agr.asu.edu.eg/bd-screen/20260519195342/screen 0xa51-222-A0A1U9ZNZ9-F1-model_v6.pdb ahmedgamal_Soliman@agr.asu.edu.eg FDA-approved2026-04-22 22:27:22
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