-I: Adding /home/jwang/amber/dat/leap/prep to search path. -I: Adding /home/jwang/amber/dat/leap/lib to search path. -I: Adding /home/jwang/amber/dat/leap/parm to search path. -I: Adding /home/jwang/amber/dat/leap/cmd to search path. -s: Ignoring startup file: leaprc -f: Source leap.in. Welcome to LEaP! Sourcing: ./leap.in ----- Source: /home/jwang/amber/dat/leap/cmd/leaprc.gaff ----- Source of /home/jwang/amber/dat/leap/cmd/leaprc.gaff done Log file: ./leap.log Loading parameters: /home/jwang/amber/dat/leap/parm/gaff.dat Reading title: AMBER General Force Field for organic molecules (Version 1.4, March 2010) add. info. at the end Loading parameters: ./frcmod Reading force field modification type file (frcmod) Reading title: remark goes here Loading Prep file: ./DGN.prepin Loaded UNIT: DGN Checking Unit. Building topology. Building atom parameters. Building bond parameters. Building angle parameters. Building proper torsion parameters. Building improper torsion parameters. old PREP-specified impropers: : C1' C8 N9 C4 : H8 N9 C8 N7 : C6 C4 C5 N7 : C5 N1 C6 O6 : C6 C2 N1 H1 : N1 N3 C2 N2 : C2 H21 N2 H22 : C5 N9 C4 N3 --Impropers: 1 C1' - C8 - N9 - C4 1 C2 - H21 - N2 - H22 1 C5 - O6 - C6 - N1 1 C6 - H1 - N1 - C2 1 N1 - N2 - C2 - N3 1 N3 - N9 - C4 - C5 1 N7 - C6 - C5 - C4 1 N9 - H8 - C8 - N7 total 8 improper torsions applied 8 improper torsions in old prep form Building H-Bond parameters. Not Marking per-residue atom chain types. Marking per-residue atom chain types. (no restraints) Quit