dl_poly-mpich - General purpose classical molecular dynamics (MD) simulation - mpich version

Property Value
Distribution Fedora 25
Repository Fedora x86_64
Package name dl_poly-mpich
Package version 1.9.20140324
Package release 16.fc24
Package architecture x86_64
Package type rpm
Installed size 2.46 MB
Download size 1.01 MB
Official Mirror dl.fedoraproject.org
DL_POLY Classic is a general purpose molecular dynamics simulation
package developed at Daresbury Laboratory by W. Smith, T.R. Forester
and I.T. Todorov.  It is based on the package DL_POLY_2, which was
originally developed by the Computational Chemistry Group, (CCG) at
Daresbury Laboratory under the auspices of the Engineering and
Physical Sciences Research Council (EPSRC) for (CCP5), the EPSRC's
Collaborative Computational Project for the Computer Simulation of
Condensed Phases.
DL_POLY Classic can be executed as a serial or a parallel application.
The code achieves parallelisation using the Replicated Data strategy
which is suitable for homogeneous, distributed-memory, parallel
computers.  The code is useful for simulations of up to 30,000 atoms
with good parallel performance on up to 100 processors, though in some
circumstances it can exceed or fail to reach these limits.
Reference: I.T. Todorov, W. Smith, K. Trachenko & M.T. Dove,
Journal of Materials Chemistry, (2006) 16, 1911-1918
This is a parallel version using mpich.


Package Version Architecture Repository
dl_poly-mpich-1.9.20140324-16.fc24.i686.rpm 1.9.20140324 i686 Fedora
dl_poly-mpich - - -


Name Value
dl_poly-common = 1.9.20140324-16.fc24
libc.so.6(GLIBC_2.4)(64bit) -
libgcc_s.so.1()(64bit) -
libgcc_s.so.1(GCC_4.0.0)(64bit) -
libgfortran.so.3()(64bit) -
libgfortran.so.3(GFORTRAN_1.0)(64bit) -
libgfortran.so.3(GFORTRAN_1.4)(64bit) -
libm.so.6()(64bit) -
libm.so.6(GLIBC_2.2.5)(64bit) -
libmpi.so.12()(64bit)(mpich-x86_64) -
libmpifort.so.12()(64bit)(mpich-x86_64) -
libquadmath.so.0()(64bit) -
mpich(x86-64) -
rtld(GNU_HASH) -


Name Value
dl_poly-mpich = 1.9.20140324-16.fc24
dl_poly-mpich(x86-64) = 1.9.20140324-16.fc24


Type URL
Binary Package dl_poly-mpich-1.9.20140324-16.fc24.x86_64.rpm
Source Package dl_poly-1.9.20140324-16.fc24.src.rpm

Install Howto

Install the dl_poly-mpich rpm package:

# dnf install dl_poly-mpich




See dl_poly-1.9.20140324-16.fc24.x86_64.rpm changelog.

See Also

Package Description
dl_poly-openmpi-1.9.20140324-16.fc24.x86_64.rpm General purpose classical molecular dynamics (MD) simulation - openmpi version
dleyna-connector-dbus-0.2.0-7.fc24.i686.rpm D-Bus connector for dLeyna services
dleyna-connector-dbus-0.2.0-7.fc24.x86_64.rpm D-Bus connector for dLeyna services
dleyna-connector-dbus-devel-0.2.0-7.fc24.i686.rpm Development files for dleyna-connector-dbus
dleyna-connector-dbus-devel-0.2.0-7.fc24.x86_64.rpm Development files for dleyna-connector-dbus
dleyna-core-0.5.0-4.fc25.i686.rpm Utilities for higher level dLeyna libraries
dleyna-core-0.5.0-4.fc25.x86_64.rpm Utilities for higher level dLeyna libraries
dleyna-core-devel-0.5.0-4.fc25.i686.rpm Development files for dleyna-core
dleyna-core-devel-0.5.0-4.fc25.x86_64.rpm Development files for dleyna-core
dleyna-renderer-0.5.0-5.fc25.i686.rpm Service for interacting with Digital Media Renderers
dleyna-renderer-0.5.0-5.fc25.x86_64.rpm Service for interacting with Digital Media Renderers
dleyna-renderer-devel-0.5.0-5.fc25.i686.rpm Development files for dleyna-renderer
dleyna-renderer-devel-0.5.0-5.fc25.x86_64.rpm Development files for dleyna-renderer
dleyna-server-0.5.0-4.fc25.i686.rpm Service for interacting with Digital Media Servers
dleyna-server-0.5.0-4.fc25.x86_64.rpm Service for interacting with Digital Media Servers