< < |
GAIA |
Einstein-Tk |
NEMO |
NAMD |
QuantumEpresso<-- --> |
RegCM |
1 - Parallelization Model (MPI, openMP, Hybrid, GPU, .. ) |
Mem-bound |
1GB per core |
1GB per core |
no |
1-2 GB |
No |
10 - Applications needed on the WN. Specify version if important (QE, gaussian,..) |
No |
20GB output |
10GB input |
10GB output |
10 GB output |
100GB |
11 - Large amount of Data (No, 10GB Input, 20-30 GB output) |
12 - Data Intensive (No, SAN=High speed SAN, Local=Local scratch disks, .. ) |
13 - Expected Execution time (No=within a few hours, 24-48h, 72h or more ) |
14 - Checkpoints (No, Yes=I need a safe local storage area to save CheckPoints ) |
15 - Communication Intensive (No, Infiniband, ... ) |
16 - Web portal (No=not needed, D=yes for Data management, CI= yes with Custmized Interface, ... ) |
2- CPU requirements (1-10 WholeNodes, 16-24 CPUs, ..) |
3 - Memory requirements ( No, 1-2 GB per core, Memory-Bound=whole avail. mem. ) |
4 - Match Making (Yes=WMS can find a suitable resource, No = I select the resource ) |
5 - Code Developer (P=personal ,OS=OpenSource, C=Commercial, ...) |
6 - Compiler/Version needed on the WN (No=compiled on the UI, gcc/g++, icc, Java ..) |
7 - Libraries/version needed on the WN (COMPILE time) (no=compiled on the UI, Blas, Lapack, Gsl, ..) |
? |
>72h |
>72h |
>3 weeks |
72 or more |
72 or mode |
8 - Libraries needed on the WN (EXECUTION time) (Blas, Lapack, Gsl, ..) |
9 - Interpreter needed on the WN (Python, perl, ..) |
No |
Infiniband |
no (single node) |
infiniband if more than 3 physical nodes used |
IB |
no |
MPI/openMP |
MPI/openMP |
MPI/openMP |
MPI/openMP |
MPI/openMP GPU |
MPI |
No |
No |
No |
Yes (no preinstalled exe) |
No |
Yes |
gcc-c++ |
f90, gcc-c++ |
NO |
NO |
No |
No |
cfitsio |
blas, lapack, gsl, hdf5, fftw3 |
if compiled, netcdf |
no |
no |
no |
cfitsio |
blas, lapack, gsl, hdf5, fftw3 |
no (netcdf statically linked) |
no |
no |
no |
no |
no |
Pyhton wrapper created |
No |
no |
no |
CI |
CI |
CI |
No |
No |
D |
OS+P |
OS+P |
P+OS |
OS |
OS |
OS |
no |
no |
no |
no |
QE-yes |
no |
No |
SAN |
No |
No |
SAN/Local |
No |
8-64 WholeNodes |
1-64 WholeNodes |
SingleNode or Multinode with SharedHome |
1-1024 |
WholeNodes 8-128 |
WN 1 |
No |
Yes |
can continue on different sites |
No, output is retrieved via SE |
Yes, on the same site |
No, files are saved to custom storage via OpenDAP |
|
> > |
|
GAIA |
Einstein-Tk |
NEMO |
NAMD |
QuantumEpresso |
RegCM |
1 |
Code Developer - E.g.: P(=personal) ,OS(=OpenSource), C(=Commercial), ... |
|
OS+P |
OS+P |
OS+P |
OS |
OS |
OS |
2 |
Parallelization Model - E.g.: MPI, openMP, Hybrid, GPU, .. |
|
MPI/openMP |
MPI/openMP |
MPI/openMP |
MPI/openMP |
MPI/openMP GPU |
MPI |
3 |
CPU requirements - E.g.: 1-10 WholeNodes, 16-24 CPUs, .. |
|
8-64 WholeNodes |
1-64 WholeNodes |
1 or more WholeNode Node |
1-1024 |
8-128 WholeNodes |
1 WholeNode |
4 |
Memory requirements - E.g.: No, 1-2 GB per core, Memory-Bound(=whole avail. mem.), .. |
|
Mem-bound |
1GB per core |
1GB per core |
no |
1-2 GB |
No |
5 |
Match Making - Yes(wms can find a suitable resource), No( I select the resource) |
|
No |
No |
No |
Yes (no preinstalled exe) |
No |
Yes |
6 |
Compiler/Version needed on the WN - E.g.: No=compiled on the UI, gcc/g++, icc, Java ..) |
|
gcc-c++ |
f90, gcc-c++ |
NO |
NO |
No |
No |
7 |
Libraries/version needed on the WN (COMPILE time) - E.g.: no(=compiled on the UI), Blas, Lapack, Gsl, .. |
|
cfitsio |
blas, lapack, gsl, hdf5, fftw3 |
if compiled, netcdf |
no |
no |
no |
8 |
Libraries needed on the WN (EXECUTION time) - E.g.: Blas, Lapack, Gsl, .. |
|
cfitsio |
blas, lapack, gsl, hdf5, fftw3 |
no (netcdf statically linked) |
no |
no |
no |
9 |
Interpreter needed on the WN - E.g.: Python, perl, .. |
|
no |
no |
Pyhton wrapper created |
No |
no |
no |
10 |
Applications on the WN - Name and version (if important) of a needed Application (QE, gaussian,..) |
|
no |
no |
no |
no |
QE-latest-vers |
no |
11 |
Large amount of Data - E.g.: No, 10GB Input, 20-30 GB output, ... |
|
No |
20GB output |
10GB input |
10GB output |
10 GB output |
100GB |
12 |
Data Intensive - E.g.: No(=don't care), SAN(=Shared High speed SAN), Local(=1 Local scratch disk per Node, .. ) |
|
No |
SAN |
No |
No |
SAN/Local |
No, files are saved to custom storage via OpenDAP |
13 |
Expected Execution time - E .g.: No=within a few hours, 24-48h, 72h or more,.. |
|
? |
>72h |
>72h |
>3 weeks |
72 or more |
72 or mode |
14 |
Checkpoints - E.g.: No(=don't care) Yes(=I need a safe local storage area to save CheckPoints ) |
|
No |
Yes |
can continue on different sites |
No, output is retrieved via SE |
Yes, on the same site |
No, files are saved to custom storage via OpenDAP |
15 |
Communication Intensive - E.g.: No (=don't care) , IB(=Infiniband needed) , ... |
|
No |
IB |
No |
IB if more than 3 physical nodes used |
IB |
no |
16 |
Web portal - E.g.: No(not needed), D(=yes for Data management), CI ( yes with Custmized Interface), CHK=(Checkpoint support)... |
|
CI |
CI |
CI |
No |
No |
D |
|