dl_poly - General purpose classical molecular dynamics (MD) simulation

Property Value
Distribution Fedora 25
Repository Fedora x86_64
Package name dl_poly
Package version 1.9.20140324
Package release 16.fc24
Package architecture x86_64
Package type rpm
Installed size 2.45 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 serial version.


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


Name Value
dl_poly-common = 1.9.20140324-16.fc24
libc.so.6(GLIBC_2.2.5)(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) -
libquadmath.so.0()(64bit) -
rtld(GNU_HASH) -


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


Type URL
Binary Package dl_poly-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 rpm package:

# dnf install dl_poly




2016-02-03 - Fedora Release Engineering <releng@fedoraproject.org> - 1.9.20140324-16
- Rebuilt for https://fedoraproject.org/wiki/Fedora_24_Mass_Rebuild
2015-09-15 - Orion Poplawski <orion@cora.nwra.com> - 1.9.20140324-15
- Rebuild for openmpi 1.10.0
2015-08-15 - Zbigniew Jędrzejewski-Szmek <zbyszek@in.waw.pl> - 1.9.20140324-14
- Rebuild for MPI provides
2015-07-27 - Sandro Mani <manisandro@gmail.com> - 1.9.20140324-13
- Rebuild for RPM MPI Requires Provides Change
2015-06-17 - Fedora Release Engineering <rel-eng@lists.fedoraproject.org> - 1.9.20140324-12
- Rebuilt for https://fedoraproject.org/wiki/Fedora_23_Mass_Rebuild
2015-03-18 - Dave Love <d.love@liverpool.ac.uk> - 1.9.20140324-11
- Rebuild for mpich change
2015-02-22 - Dave Love <d.love@liverpool.ac.uk> - 1.9.20140324-10
- Drop java minimum version (for ppc64 el6)
2015-02-20 - Dave Love <d.love@liverpool.ac.uk> - 1.9.20140324-9
- Specify permissions for installed .jar
2015-02-19 - Dave Love <d.love@liverpool.ac.uk> - 1.9.20140324-8
- Conditionalize out mpich on ppc64 el6
2015-02-11 - Dave Love <d.love@liverpool.ac.uk> - 1.9.20140324-7
- Remove _isa on -common and java requires

See Also

Package Description
dl_poly-common-1.9.20140324-16.fc24.noarch.rpm General purpose classical molecular dynamics (MD) simulation - common files
dl_poly-doc-1.9.20140324-16.fc24.noarch.rpm Documentation for dl_poly and dl_poly-gui
dl_poly-gui-1.9.20140324-16.fc24.noarch.rpm GUI for dl_poly
dl_poly-mpich-1.9.20140324-16.fc24.x86_64.rpm General purpose classical molecular dynamics (MD) simulation - mpich version
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