source leaprc.ff03 source leaprc.gaff loadoff benz.lib loadoff phen.lib complex = loadpdb complex.pdb setbox complex vdw savepdb complex t4_bnz_leap.pdb saveamberparm complex t4_bnz.prm t4_bnz.rst ligand = loadpdb ligand.pdb setbox ligand vdw savepdb ligand bnz_leap.pdb saveamberparm ligand bnz.prm bnz.rst complex = loadpdb t4_phn.pdb setbox complex vdw savepdb complex t4_phn_leap.pdb saveamberparm complex t4_phn.prm t4_phn.rst ligand = loadpdb phn.pdb setbox ligand vdw savepdb ligand phn_leap.pdb saveamberparm ligand phn.prm phn.rst