yank - Revision 1182: /test-systems/FKBP/amber-gbsa/LG8

• ..
• ANTECHAMBER_AC.AC
• ANTECHAMBER_AC.AC0
• ANTECHAMBER_AM1BCC.AC
• ANTECHAMBER_AM1BCC_PRE.AC
• ANTECHAMBER_BOND_TYPE.AC
• ANTECHAMBER_BOND_TYPE.AC0
• ATOMTYPE.INF
• LG8.crd
• LG8.frcmod
• LG8.gaff.mol2
• LG8.mol2
• LG8.off
• LG8.openeye.mol2
• LG8.pdb
• LG8.prmtop
• antechamber.out
• complex-min.sander.out
• complex-minimized.crd
• complex-testenergy.sander.out
• complex.crd
• complex.pdb
• complex.prmtop
• divcon.pdb
• leap.log
• ligand-min.sander.out
• ligand-minimized.crd
• ligand-testenergy.sander.out
• ligand.crd
• ligand.pdb
• ligand.prmtop
• mdinfo
• min.sander.in
• mopac.in
• mopac.out
• mopac.pdb
• receptor-min.sander.out
• receptor-minimized.crd
• receptor-testenergy.sander.out
• receptor.crd
• receptor.pdb
• receptor.prmtop
• setup-ligand.leap.in
• setup-ligand.leap.out
• setup.leap.in
• setup.leap.out
• testenergy.sander.in