Oprogramowanie: Różnice pomiędzy wersjami

Wersja z 08:50, 2 sie 2012

Spis treści

1 Aplikacje
2 Kompilatory
3 Narzędzia i biblioteki

Aplikacje

Dostępne aplikacje i ich wersje
Aplikacja	Baribal	Mars	Panda	Zeus	Zeus GPGPU
ABAQUS	6.x	6.x	6.x	6.10
ABINIT				2.0
ACES				2
ADF				2010.02
AMBER				11
ANSYS				13.0.0 14.0.0
ANSYS Fluent				13.0.0 14.0.0
Autodock				4.2.3
Blender				2.49b
Cadence				2009cdb 2009oa 2010cdb 2010oa
CFOUR				1.0
CP2K				2.1
CPMD				3.13-2
Dalton				2.0
Desmond				3.0.3.1
Dimemas					3.00.22
Elegant				25.0.3
Extrae				2.2.1
ForgeG					20110408
Galaxy-central
GAMESS				2009.R3 2010.R1 2010.R1-eth 2010.R1-ib	2010.R1 2011.R1
Gaussian	G03(E.01) G09(A.02)	G03(D.01) G09(A.02)	G03(E.01)	G03(E.01) G09(A.02) G09(C.01)
Gemini2
Genesis				2.3
Gromacs				4.5.3
Head_Refined
Hp2d-parallel-typhoon
IM & IMa
Jed				0.99-19
Lammps				30Sep11
Magpar				0.9
Mathematica		8.0		8.0
MATLAB		R2010b R2011b R2012a		R2010b R2012a
Maple		14		14 15
Meep				1.1.1
Metis
Mira				3.4.3
Molcas				7.4
Molpro				2010.1-24 2010.1-25
MrBayes
NAMD				2.7b2 2.7b4 2.8	2.7 2.8 2.9
NCARG				6.0.0
NWChem				6.1
OOMMF				1.2a4
OpenFOAM				1.7.1
ORCA				2.8
Packmol				1.1.0.68 1.1.2.023
Paraver					4.3.2
Paraver-kernel					1.0
ParaView				3.8.1
POV-Ray				3.6
Quantum ESPRESSO				4.3.2
Roche				2.5.3
Rosetta				3.3
SIESTA				3.0rc2
SQLite				3.7.9
TeraChem					1.45 1.5
Turbomole				6.3.1 6.4
Valgrind				3.7.0
Vasp				4.6
XCrySDen				1.5.25
XML-RPC-C				1.16.26 1.22.00

Kompilatory

Dostępne kompilatory
Kompilator	Zeus	Zeus GPGPU
GNU	4.1.2 4.5.3
Intel	10.1 11.0 11.1 12.0 12.1
Java	1.6.0_23 1.7.0_05
NVCC		4.0
Portland	8.06 9.2 10.5 11.3 11.6 11.8 11.6
Python	2.7.2 (UCS2) 2.7.3 (UCS4)
Ruby	1.9.1-p376

Narzędzia i biblioteki

Narzędzia i biblioteki
Nazwa	Baribal	Mars	Panda	Zeus	Zeus GPGPU	Zeus vSMP
ATLAS
BLACS
BLAS
Boost
CUDA					4.0.17
CUBLAS					4.0.17
CUFFT					4.0.17
CURAND					4.0.17
CUSPARSE					4.0.17
FFTW				3.2.2 3.3.2
GCC				4.1.2 4.5.3
GLPK				4.47
Gnuplot				4.4.2
GSL				1.14
IMPI				3.2.2.006
LAPACK
MAGMA					1.0.0-rc5
MKL				08.0.1 10.2.2.025 10.3
MPICH				1.2.7p1
Mpiexec				0.84
NPP					4.0.17
OpenCL	-	-	-	-		-
OpenMPI				1.4.3 1.4.5 1.6.0
PD-Toolkit				3.17
QT
R				2.14.1
ROOT				5.24
SAILFISH					0.3
SCALAPACK
SCons				2.1.0
TAU				2.21.1
Visit				2.3.2

@@ Linia 9: / Linia 9: @@
 | [[ABAQUS]] || [[Abaqus|6.x]] || [[Mars:Abaqus|6.x]] || [[Abaqus|6.x]] ||colspan="3" align="center"| [[Zeus:Abaqus|6.10]]
 |-
-| [[ABINIT]] || || || || [[Zeus:ABINIT|2.0]] || ||
+| [[ABINIT]] || || || || [[Zeus:ABINIT#2.0|2.0]] || ||
 |-
-| [[ACES]] || || || || [[Zeus:ACES|2]] || ||
+| [[ACES]] || || || || [[Zeus:ACES#2|2]] || ||
 |-
-| [[ADF]] || || || || [[Zeus:ADF|2010.02]] || ||
+| [[ADF]] || || || || [[Zeus:ADF#2010.02|2010.02]] || ||
 |-
-| [[AMBER]] || || || ||colspan="2" align="center"| [[Zeus:AMBER|11]] ||
+| [[AMBER]] || || || ||colspan="2" align="center"| [[Zeus:AMBER#11|11]] ||
 |-
-| [[ANSYS]] || || || ||colspan="3" align="center"| [[Zeus:ANSYS|13.0.0]] <br/> [[Zeus:ANSYS|14.0.0]]
+| [[ANSYS]] || || || ||colspan="3" align="center"| [[Zeus:ANSYS#13.0.0|13.0.0]] <br/> [[Zeus:ANSYS#14.0.0|14.0.0]]
 |-
-| [[ANSYS Fluent]] || || || || colspan="3" align="center"| [[Zeus:ANSYS_Fluent|13.0.0]] <br/> [[Zeus:ANSYS_Fluent|14.0.0]]
+| [[ANSYS Fluent]] || || || || colspan="3" align="center"| [[Zeus:ANSYS_Fluent#13.0.0|13.0.0]] <br/> [[Zeus:ANSYS_Fluent#14.0.0|14.0.0]]
 |-
-| [[Autodock]] || || || || [[Zeus:Autodock|4.2.3]] || ||
+| [[Autodock]] || || || || [[Zeus:Autodock#4.2.3|4.2.3]] || ||
 |-
-| [[Blender]] || || || || [[Zeus:Blender|2.49b]] || ||
+| [[Blender]] || || || || [[Zeus:Blender#2.49b|2.49b]] || ||
 |-
 | [[Cadence]] || || || || [[Zeus:Cadence#2009cdb|2009cdb]] <br/> [[Zeus:Cadence#2009oa|2009oa]] <br/> [[Zeus:Cadence#2010cdb|2010cdb]] <br/> [[Zeus:Cadence#2010oa|2010oa]]|| ||
@@ Linia 40: / Linia 40: @@
 |-
 | [[Elegant]] || || || || [[Zeus:Elegant#25.0.3|25.0.3]] || ||
+|-
+| [[Extrae]] || || || || [[Zeus:Extrae#2.2.1|2.2.1]] || ||
 |-
 | [[ForgeG]] || || || || || [[Zeus:Elegant#20110408|20110408]] ||
@@ Linia 52: / Linia 54: @@
 |-
 | [[Genesis]] || || || || colspan="3" align="center"|[[Zeus:GENESIS#2.3|2.3]]
-|-
-| [[Gnuplot]] || || || || colspan="3" align="center"|[[Zeus:Gnuplot#4.4.2|4.4.2]]
 |-
 | [[Gromacs]] || || || ||colspan="2" align="center"|[[Zeus:Gromacs#4.5.3|4.5.3]]||
@@ Linia 62: / Linia 62: @@
 |-
 | [[IM & IMa]] || || || || || ||
+|-
+| [[Jed]] || || || || [[Zeus:Jed#0.99-19|0.99-19]] || ||
 |-
 | [[Lammps]] || || || || [[Zeus:Lammps#30Sep11|30Sep11]] || ||
@@ Linia 87: / Linia 89: @@
 | [[NAMD]] || || || ||[[Zeus:NAMD#2.7b2|2.7b2]] <br /> [[Zeus:NAMD#2.7b4|2.7b4]] <br /> [[Zeus:NAMD#2.8|2.8]] || [[Zeus_GPGPU:NAMD#2.7|2.7]] <br /> [[Zeus_GPGPU:NAMD#2.8|2.8]] <br /> [[Zeus_GPGPU:NAMD#2.9|2.9]] ||
+|-
+| [[NCARG]] || || || ||[[Zeus:NCARG#6.0.0|6.0.0]] || ||
 |-
 | [[NWChem]] || || || ||colspan="3" align="center"|[[Zeus:NWChem#6.1|6.1]]
@@ Linia 106: / Linia 110: @@
 | [[POV-Ray]] || || || ||[[Zeus:POV-Ray#3.6|3.6 ]] || ||
 |-
-| [[Quantum ESPRESSO]] || || || ||[[Zeus:Quantum_ESPRESSO|4.3.2 ]] || ||
+| [[Quantum ESPRESSO]] || || || ||[[Zeus:Quantum_ESPRESSO#4.3.2|4.3.2 ]] || ||
 |-
 | [[Roche]] || || || ||[[Zeus:Roche#2.5.3|2.5.3 ]] || ||
 |-
-| [[ROOT]] || || || ||[[Zeus:ROOT#5.24|5.24 ]] || ||
+| [[Rosetta]] || || || ||[[Zeus:Rosetta#3.3|3.3 ]] || ||
 |-
-| [[Rosetta]] || || || ||[[Zeus:Rosetta#3.3|3.3 ]] || ||
+| [[SIESTA]] || || || ||[[Zeus:SIESTA#3.0rc2|3.0rc2 ]] || ||
 |-
 | [[SQLite]] || || || || colspan="3" align="center"|[[Zeus:SQLite#3.7.9|3.7.9]]
 |-
-| [[Turbomole]] || || || || || ||
+| [[TeraChem]] || || || || || [[Zeus:TeraChem#1.45|1.45]] <br> [[Zeus:TeraChem#1.5|1.5]] ||
 |-
-| [[TeraChem]] || || || || || 1.45 <br> 1.5 ||
+| [[Turbomole]] || || || || [[Zeus:Turbomole#6.3.1|6.3.1]] <br /> [[Zeus:Turbomole#6.4|6.4]] || ||
+|-
+| [[Valgrind]] || || || || [[Zeus:Valgrind#3.7.0|3.7.0]] || ||
+|-
+| [[Vasp]] || || || || [[Zeus:Vasp#4.6|4.6]] || ||
+|-
+| [[XCrySDen]] || || || || [[Zeus:XCrySDen#1.5.25|1.5.25]] || ||
+|-
+| [[XML-RPC-C]] || || || || [[Zeus:XML-RPC-C#1.16.26|1.16.26]] <br /> [[Zeus:XML-RPC-C#1.22.00|1.22.00]]|| ||
 |}
@@ Linia 134: / Linia 146: @@
 | [[Zeus:Java|Java]] || || || || [[Zeus:Java#1.6.0_23|1.6.0_23 ]]<br>[[Zeus:Java#1.7.0_05|1.7.0_05 ]] || ||
 |-
-| [[NVCC]] || || || || || 4.0 ||
+| [[NVCC]] || || || || || [[Zeus_GPGPU:NVCC#4.0|4.0]] ||
 |-
 | [[Portland]] || || || ||[[Zeus:Portland#8.06|8.06 ]] <br /> [[Zeus:Portland#9.2|9.2 ]] <br /> [[Zeus:Portland#10.5|10.5 ]] <br /> [[Zeus:Portland#11.3|11.3 ]] <br /> [[Zeus:Portland#11.6|11.6 ]] <br /> [[Zeus:Portland#11.8|11.8 ]] <br /> [[Zeus:Portland|11.6 ]] <br />|| ||
 |-
-| [[Python]] || || || ||[[Zeus:Python|2.7 ]] || ||
+| [[Python]] || || || ||[[Zeus:Python#2.7.2|2.7.2 (UCS2)]] <br />  [[Zeus:Python#2.7.3|2.7.3 (UCS4)]] || ||
 |-
 | [[Ruby]] || || || || [[Zeus:Ruby#1.9.1-p376|1.9.1-p376 ]]|| ||
@@ Linia 157: / Linia 169: @@
 | [[Boost]] || || || || || ||
 |-
-| [[CUDA]] || || || || || 4.0.17 ||
+| [[CUDA]] || || || || || [[Zeus_GPGPU:CUDA#4.0.17|4.0.17]] ||
 |-
-| [[CUBLAS]] || || || || || 4.0.17 ||
+| [[CUBLAS]] || || || || || [[Zeus_GPGPU:CUBLAS#4.0.17|4.0.17]] ||
 |-
-| [[CUFFT]] || || || || || 4.0.17 ||
+| [[CUFFT]] || || || || || [[Zeus_GPGPU:CUFFT#4.0.17|4.0.17]] ||
 |-
-| [[CURAND]] || || || || || 4.0.17 ||
+| [[CURAND]] || || || || || [[Zeus_GPGPU:CURAND#4.0.17|4.0.17]] ||
 |-
-| [[CUSPARSE]] || || || || || 4.0.17 ||
+| [[CUSPARSE]] || || || || || [[Zeus_GPGPU:CUSPARSE#4.0.17|4.0.17]] ||
 |-
 | [[FFTW]] || || || || colspan="3" align="center"|[[Zeus:FFTW#3.2.2|3.2.2]] <br /> [[Zeus:FFTW#3.3.2|3.3.2]]
@@ Linia 172: / Linia 184: @@
 |-
 | [[GLPK]] || || || || colspan="3" align="center"|[[Zeus:GLPK#4.47|4.47]]
+|-
+| [[Gnuplot]] || || || || colspan="3" align="center"|[[Zeus:Gnuplot#4.4.2|4.4.2]]
 |-
 | [[GSL]] || || || || colspan="3" align="center"|[[Zeus:GSL#1.14|1.14]]
@@ Linia 190: / Linia 204: @@
 |-
 | [[OpenCL]] || - || - || - || - || || -
+|-
+| [[OpenMPI]] || || || || colspan="3" align="center"|[[Zeus:OpenMPI#1.4.3|1.4.3]] <br /> [[Zeus:OpenMPI#1.4.5|1.4.5]] <br /> [[Zeus:OpenMPI#1.6.0|1.6.0]]
+|-
+| [[PD-Toolkit]] || || || ||[[Zeus:PD-Toolkit#3.17|3.17 ]] || ||
 |-
 | [[QT]] || || || || || ||
 |-
 | [[R]] || || || || colspan="3" align="center"|[[Zeus:R#2.14.1|2.14.1]]
+|-
+| [[ROOT]] || || || ||[[Zeus:ROOT#5.24|5.24 ]] || ||
 |-
 | [[SAILFISH]] || || || || || [[Zeus:Sailfish#0.3|0.3]] ||
@@ Linia 201: / Linia 221: @@
 | [[SCons]] || || || || [[Zeus:SCons#2.1.0|2.1.0]] || ||
 |-
-| [[Visit]] || || || || || ||
+| [[TAU]] || || || || [[Zeus:TAU#2.21.1|2.21.1]] || ||
+|-
+| [[Visit]] || || || || [[Zeus:Visit#2.3.2|2.3.2]] || ||
 |}