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最后更新： 2020-01-03 18:32:20

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源码介绍
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分类

数值算法/人工智能

参数1

参数2

参数3

参数4

参数5

参数6

大小

2 MB

发货方式

自动发货

下载方式

远程下载

备注说明

所属分类：生物技术
开发工具：Fortran
文件大小：497KB
下载次数：6
上传日期：2012-11-13 13:40:04

说明：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 ! )

文件列表：

amberfile_io.F90,39016,2007-10-05
ATOMS.F90,9885,2007-10-05
atom_manipulation.F90,10472,2007-10-05
baker_optimization.F90,16788,2007-10-05
BLASD.F,219179,2007-10-05
build_coordinates.F90,20133,2007-10-05
conjugate_gradient.F90,17303,2007-10-05
connectivity.F90,31710,2007-10-05
constants.F90,7936,2007-10-05
constraint.F90,43092,2007-10-05
coordinate_io.F90,23135,2007-10-05
dcd_analysis.F90,19236,2007-10-05
DCD_IO.F90,20356,2007-10-05
definitions.F90,3391,2007-10-05
diagonalization.F90,7126,2007-10-05
dynamics_langevin_verlet.F90,8158,2007-10-05
dynamics_leapfrog_verlet.F90,9983,2007-10-05
dynamics_utilities.F90,15831,2007-10-05
dynamics_velocity_verlet.F90,8655,2007-10-05
DYNAMO.F90,5230,2007-10-05
ELEMENTS.F90,8171,2007-10-05
ENERGY.F90,12548,2007-10-05
energy_covalent.F90,42401,2007-10-05
energy_nb.F90,45792,2007-10-05
energy_nb_abfs.F90,45802,2007-10-05
energy_nb_ewald.F90,38972,2007-10-05
energy_nb_full.F90,14170,2007-10-05
FILES.F90,3089,2007-10-05
gaussian_basis.F90,41661,2007-10-05
GEOMETRY.F90,19779,2007-10-05
IO_UNITS.F90,2135,2007-10-05
LAPACK.F,402742,2007-10-05
LAPACK_DLAMC1.F,5228,2007-10-05
LBFGS.F90,10032,2007-10-05
linear_algebra.F90,11416,2007-10-05
linear_equations.F90,2967,2007-10-05
mm_file_data.F90,14256,2007-10-05
mm_file_io.F90,50474,2007-10-05
mm_system.F90,56220,2007-10-05
mm_system_edit.F90,27561,2007-10-05
mm_system_io.F90,7623,2007-10-05
MM_TERMS.F90,8979,2007-10-05
monte_carlo.F90,25634,2007-10-05
monte_carlo_energy.F90,10798,2007-10-05
mopac_analysis.F90,37181,2007-10-05
mopac_data.F90,10818,2007-10-05
mopac_density.F90,10905,2007-10-05
mopac_fock.F90,24201,2007-10-05
mopac_gradients.F90,51064,2007-10-05
mopac_hamiltonian.F90,30578,2007-10-05
mopac_integrals.F90,64124,2007-10-05
mopac_parameters.F90,98610,2007-10-05
mopac_scf.F90,36956,2007-10-05
multipoles.F90,9039,2007-10-05
neb_climb.F90,48827,2007-10-05
neb_spline.F90,66317,2007-10-05
normal_mode.F90,14598,2007-10-05
normal_mode_utilities.F90,9561,2007-10-05
numerical_derivatives.F90,7189,2007-10-05
optimize_bfgs.F90,15355,2007-10-05
optimize_coordinates.F90,8336,2007-10-05
PARSING.F90,24692,2007-10-05
PDB_IO.F90,17174,2007-10-05
PRINTING.F90,38701,2007-10-05
quantum_energy.F90,13107,2007-10-05
quantum_properties.F90,10136,2007-10-05
quickdock.F90,96161,2007-10-05
RANDOM.F90,17047,2007-10-05
reaction_path.F90,12612,2007-10-05
SAS.F90,25210,2007-10-05
self_avoiding_walk.F90,24696,2007-10-05
SEQUENCE.F90,10453,2007-10-05
SORT.F90,9749,2007-10-05
special_functions.F90,5738,2007-10-05
statistics.F90,5736,2007-10-05
STRING.F90,8084,2007-10-05
superimpose.F90,17699,2007-10-05
SYMMETRY.F90,10052,2007-10-05
thermodynamics_RRHO.F90,16179,2007-10-05
TIME.F90,3939,2007-10-05
transformation.F90,13207,2007-10-05
VELOCITY.F90,15511,2007-10-05
WHAM.F90,12581,2007-10-05
XYZ_IO.F90,14509,2007-10-05
ZMATRIX.F90,9860,2007-10-05
zmatrix_io.F90,18830,2007-10-05