压缩包 : 25811214dynamo.rar 列表
dynamo1\atom_manipulation.f90
dynamo1\atoms.f90
dynamo1\baker_optimization.f90
dynamo1\BLASD.f
dynamo1\build_coordinates.f90
dynamo1\conjugate_gradient.f90
dynamo1\connectivity.f90
dynamo1\constants.f90
dynamo1\constraint.f90
dynamo1\coordinate_io.f90
dynamo1\dcd_analysis.f90
dynamo1\dcd_io.f90
dynamo1\definitions.f90
dynamo1\diagonalization.f90
dynamo1\dynamics_langevin_verlet.f90
dynamo1\dynamics_leapfrog_verlet.f90
dynamo1\dynamics_utilities.f90
dynamo1\dynamics_velocity_verlet.f90
dynamo1\dynamo.f90
dynamo1\elements.f90
dynamo1\energy.f90
dynamo1\energy_covalent.f90
dynamo1\energy_nb.f90
dynamo1\energy_nb_afs.f90
dynamo1\energy_nb_ewald.f90
dynamo1\energy_nb_full.f90
dynamo1\files.f90
dynamo1\gaussian_basis.f90
dynamo1\geometry.f90
dynamo1\io_units.f90
dynamo1\LAPACK.f
dynamo1\linear_algebra.f90
dynamo1\linear_equations.f90
dynamo1\mm_file_data.f90
dynamo1\mm_file_io.f90
dynamo1\mm_system.f90
dynamo1\mm_system_edit.f90
dynamo1\mm_system_io.f90
dynamo1\mm_terms.f90
dynamo1\monte_carlo.f90
dynamo1\monte_carlo_energy.f90
dynamo1\mopac_analysis.f90
dynamo1\mopac_data.f90
dynamo1\mopac_density.f90
dynamo1\mopac_fock.f90
dynamo1\mopac_gradients.f90
dynamo1\mopac_hamiltonian.f90
dynamo1\mopac_integrals.f90
dynamo1\mopac_parameters.f90
dynamo1\mopac_scf.f90
dynamo1\multipoles.f90
dynamo1\normal_mode.f90
dynamo1\normal_mode_utilities.f90
dynamo1\numerical_derivatives.f90
dynamo1\optimize_coordinates.f90
dynamo1\parsing.f90
dynamo1\pdb_io.f90
dynamo1\printing.f90
dynamo1\quantum_energy.f90
dynamo1\quantum_properties.f90
dynamo1\random.f90
dynamo1\reaction_path.f90
dynamo1\sas.f90
dynamo1\self_avoiding_walk.f90
dynamo1\sequence.f90
dynamo1\sort.f90
dynamo1\special_functions.f90
dynamo1\statistics.f90
dynamo1\status.f90
dynamo1\string.f90
dynamo1\superimpose.f90
dynamo1\symmetry.f90
dynamo1\thermodynamics_RRHO.f90
dynamo1\time.f90
dynamo1\transformation.f90
dynamo1\velocity.f90
dynamo1\wham.f90
dynamo1\xyz_io.f90
dynamo1\zmatrix.f90
dynamo1\zmatrix_io.f90
dynamo1