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分子模拟软件fDynamo v2.2
的源程序
-
!
! fDynamo v2.2- a program for performing molecular simulations.
! Copyright (C) 2005-2007 Martin J. Field
!
!===============================================================================
!
! This program is free software you can redistribute it and/or
! modify it under the terms of the GNU General Public License
! as published by the Free Software Foundation either version 2
! of the License, or (at your option) any later version.
!
! This program is distributed in the hope that it will be useful,
! but WITHOUT ANY WARRANTY without even the implied warranty of
! MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
! GNU General Public License for more details.
!
! You should have received a copy of the GNU General Public License
! along with this program if not, write to the Free Software
!
的源程序
-
!
! fDynamo v2.2- a program for performing molecular simulations.
! Copyright (C) 2005-2007 Martin J. Field
!
!===============================================================================
!
! This program is free software you can redistribute it and/or
! modify it under the terms of the GNU General Public License
! as published by the Free Software Foundation either version 2
! of the License, or (at your option) any later version.
!
! This program is distributed in the hope that it will be useful,
! but WITHOUT ANY WARRANTY without even the implied warranty of
! MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
! GNU General Public License for more details.
!
! You should have received a copy of the GNU General Public License
! along with this program if not, write to the Free Software
!
(系统自动生成,下载前可以参看下载内容)
下载文件列表
amberfile_io.F90
ATOMS.F90
atom_manipulation.F90
baker_optimization.F90
BLASD.F
build_coordinates.F90
conjugate_gradient.F90
connectivity.F90
constants.F90
constraint.F90
coordinate_io.F90
dcd_analysis.F90
DCD_IO.F90
definitions.F90
diagonalization.F90
dynamics_langevin_verlet.F90
dynamics_leapfrog_verlet.F90
dynamics_utilities.F90
dynamics_velocity_verlet.F90
DYNAMO.F90
ELEMENTS.F90
ENERGY.F90
energy_covalent.F90
energy_nb.F90
energy_nb_abfs.F90
energy_nb_ewald.F90
energy_nb_full.F90
FILES.F90
gaussian_basis.F90
GEOMETRY.F90
IO_UNITS.F90
LAPACK.F
LAPACK_DLAMC1.F
LBFGS.F90
linear_algebra.F90
linear_equations.F90
mm_file_data.F90
mm_file_io.F90
mm_system.F90
mm_system_edit.F90
mm_system_io.F90
MM_TERMS.F90
monte_carlo.F90
monte_carlo_energy.F90
mopac_analysis.F90
mopac_data.F90
mopac_density.F90
mopac_fock.F90
mopac_gradients.F90
mopac_hamiltonian.F90
mopac_integrals.F90
mopac_parameters.F90
mopac_scf.F90
multipoles.F90
neb_climb.F90
neb_spline.F90
normal_mode.F90
normal_mode_utilities.F90
numerical_derivatives.F90
optimize_bfgs.F90
optimize_coordinates.F90
PARSING.F90
PDB_IO.F90
PRINTING.F90
quantum_energy.F90
quantum_properties.F90
quickdock.F90
RANDOM.F90
reaction_path.F90
SAS.F90
self_avoiding_walk.F90
SEQUENCE.F90
SORT.F90
special_functions.F90
statistics.F90
STRING.F90
superimpose.F90
SYMMETRY.F90
thermodynamics_RRHO.F90
TIME.F90
transformation.F90
VELOCITY.F90
WHAM.F90
XYZ_IO.F90
ZMATRIX.F90
zmatrix_io.F90
ATOMS.F90
atom_manipulation.F90
baker_optimization.F90
BLASD.F
build_coordinates.F90
conjugate_gradient.F90
connectivity.F90
constants.F90
constraint.F90
coordinate_io.F90
dcd_analysis.F90
DCD_IO.F90
definitions.F90
diagonalization.F90
dynamics_langevin_verlet.F90
dynamics_leapfrog_verlet.F90
dynamics_utilities.F90
dynamics_velocity_verlet.F90
DYNAMO.F90
ELEMENTS.F90
ENERGY.F90
energy_covalent.F90
energy_nb.F90
energy_nb_abfs.F90
energy_nb_ewald.F90
energy_nb_full.F90
FILES.F90
gaussian_basis.F90
GEOMETRY.F90
IO_UNITS.F90
LAPACK.F
LAPACK_DLAMC1.F
LBFGS.F90
linear_algebra.F90
linear_equations.F90
mm_file_data.F90
mm_file_io.F90
mm_system.F90
mm_system_edit.F90
mm_system_io.F90
MM_TERMS.F90
monte_carlo.F90
monte_carlo_energy.F90
mopac_analysis.F90
mopac_data.F90
mopac_density.F90
mopac_fock.F90
mopac_gradients.F90
mopac_hamiltonian.F90
mopac_integrals.F90
mopac_parameters.F90
mopac_scf.F90
multipoles.F90
neb_climb.F90
neb_spline.F90
normal_mode.F90
normal_mode_utilities.F90
numerical_derivatives.F90
optimize_bfgs.F90
optimize_coordinates.F90
PARSING.F90
PDB_IO.F90
PRINTING.F90
quantum_energy.F90
quantum_properties.F90
quickdock.F90
RANDOM.F90
reaction_path.F90
SAS.F90
self_avoiding_walk.F90
SEQUENCE.F90
SORT.F90
special_functions.F90
statistics.F90
STRING.F90
superimpose.F90
SYMMETRY.F90
thermodynamics_RRHO.F90
TIME.F90
transformation.F90
VELOCITY.F90
WHAM.F90
XYZ_IO.F90
ZMATRIX.F90
zmatrix_io.F90
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