adding gasteiger charges to peptide sx:7 sy:7 sz:4 cx:-24.508 cy:0.540 cz:-0.141 start thread 0
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one step finished!start thread 0
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../lib/pdbqt/fdaapp_newFDA-approved View result2026-04-11 06:59:03 12 没有可运行的命令 ('lines', []) php ../php/sendResult_bd.php ../dock_file/chaurasia@skku.edu/bd-screen/20260411022050/screen 7YKM.pdb chaurasia@skku.edu FDA-approved2026-04-11 02:20:50 2026-04-11 02:20:50 2026-04-11 02:20:50 update status in workRecord success 邮件发送成功