Commits · CT-MQC_ecam · Federica Agostini / E-CAM-Library

18 Mar, 2021 10 commits
- PhysConst ok · 1dfd0c3a
  Federica Agostini authored Mar 18, 2021
  
  1dfd0c3a
- bullet list ok · a56c9df3
  Federica Agostini authored Mar 18, 2021
  
  a56c9df3
- I cut the lines in index · 1b80d575
  Federica Agostini authored Mar 18, 2021
  
  1b80d575
- getting all the new stuff · e7d6321b
  Federica Agostini authored Mar 18, 2021
```
Merge branch 'master' into CT-MQC_ecam
```
  e7d6321b
- all warnings removed · 1dd72e43
  Federica Agostini authored Mar 18, 2021
  
  1dd72e43
- removed line 119 · 6e14eeb1
  Federica Agostini authored Mar 18, 2021
  
  6e14eeb1
- remove line 90 · d8fbb2a9
  Federica Agostini authored Mar 18, 2021
  
  d8fbb2a9
- shorter lines in readme · f8a74e90
  Federica Agostini authored Mar 18, 2021
  
  f8a74e90
- new adress for the g-ctmqc project · dc7e1798
  Federica Agostini authored Mar 18, 2021
  
  dc7e1798
- another # added · 73bc4300
  Federica Agostini authored Mar 18, 2021
  
  73bc4300
17 Mar, 2021 7 commits
- Merge branch 'Kokkos_VV2' into 'master' · 02c382fa
  Alan O'Cais authored Mar 17, 2021
```
Module: VV2 using Kokkos on DL_MESO (DPD)

See merge request e-cam/E-CAM-Library!265
```
  02c382fa
- Update readme.rst · 6e7c9bd6
  Alan O'Cais authored Mar 17, 2021
  
  6e7c9bd6
- Update Meso-Multi-Scale-Modelling-Modules/modules/DL_MESO_DPD_onGPU/Kokkos_VV2/readme.rst · 148397cf
  Alan O'Cais authored Mar 17, 2021
  
  148397cf
- Fixed index.rst · 75782447
  Jony Castagna authored Mar 17, 2021
  
  75782447
- Updated and fixed index.rst · 60b4daf8
  Jony Castagna authored Mar 17, 2021
  
  60b4daf8
- Merge branch 'eessi_ci' into 'master' · b4a43735
  Alan O'Cais authored Mar 17, 2021
```
Add EESSI CI module for GitHub Actions

See merge request e-cam/E-CAM-Library!305
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  b4a43735
- Add EESSI CI module · fa01aae0
  Alan O'Cais authored Mar 17, 2021
  
  fa01aae0
12 Mar, 2021 7 commits
- correction ### · 1b943226
  Federica Agostini authored Mar 12, 2021
  
  1b943226
- Merge branch 'learnhpc_gpu' into 'master' · 0b118f9d
  Alan O'Cais authored Mar 12, 2021
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Add EESSI and general vGPU support to Magic Castle

See merge request e-cam/E-CAM-Library!303
```
  0b118f9d
- Merge remote-tracking branch 'upstream/master' into learnhpc_gpu · 50e6c855
  Alan O'Cais authored Mar 12, 2021
  
  50e6c855
- Merge branch 'eessi_gromacs' into 'master' · bcc6cc24
  Alan O'Cais authored Mar 12, 2021
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Add EESSI singularity module

See merge request e-cam/E-CAM-Library!302
```
  bcc6cc24
- Add EESSI and general vGPU support to Magic Castle · 5b2d7666
  Alan O'Cais authored Mar 12, 2021
  
  5b2d7666
- Merge branch 'Quantics_DD_MPIOMP' into 'master' · 54f400e2
  Jony Castagna authored Mar 12, 2021
```
Module_Quantics_DD_MPIOMP

See merge request e-cam/E-CAM-Library!162
```
  54f400e2
- Add additional details about how to find software · 9f9fcce8
  Alan O'Cais authored Mar 12, 2021
  
  9f9fcce8
11 Mar, 2021 16 commits
- Typo · 78e63a1b
  Alan O'Cais authored Mar 11, 2021
  
  78e63a1b
- Add to TOC tree · ed9271a1
  Alan O'Cais authored Mar 11, 2021
  
  ed9271a1
- Add EESSI singularity module · 93531cd2
  Alan O'Cais authored Mar 11, 2021
  
  93531cd2
- Merge branch 'ocaisa-master-patch-58277' into 'master' · 795b6c77
  Alan O'Cais authored Mar 11, 2021
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Update Classical-MD-Modules/index.rst,...

See merge request e-cam/E-CAM-Library!301
```
  795b6c77
- Update Classical-MD-Modules/index.rst,... · 814f9cae
  Alan O'Cais authored Mar 11, 2021
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Update Classical-MD-Modules/index.rst, Classical-MD-Modules/modules/n2p2/n2p2_training_size/readme.rst files
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  814f9cae
- Merge branch 'n2p2_training_size' into 'master' · 781cb945
  Alan O'Cais authored Mar 11, 2021
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Module: n2p2: Tools For Training Set Size Dependence

See merge request e-cam/E-CAM-Library!136
```
  781cb945
- Update readme.rst · 4c506eee
  Alan O'Cais authored Mar 11, 2021
  
  4c506eee
- Update index.rst · 24c9b307
  Alan O'Cais authored Mar 11, 2021
  
  24c9b307
- Merge branch 'openpigs' into 'master' · c732149a
  Alan O'Cais authored Mar 11, 2021
```
Module: Python bindings for running PIGS in OpenMM

See merge request e-cam/E-CAM-Library!133
```
  c732149a
- Merge branch 'n2p2_symfunc_param_generator' into 'master' · f01f35b8
  Alan O'Cais authored Mar 11, 2021
```
Module: n2p2: Symmetry Function Parameter Generator

See merge request e-cam/E-CAM-Library!137
```
  f01f35b8
- Update module from project repo to finalise module · 10b83b42
  Alan O'Cais authored Mar 11, 2021
  
  10b83b42
- Fixed path to readme · 0e9f9941
  Andreas Singraber authored Mar 11, 2021
  
  0e9f9941
- Fixed minor issues · 5d0667c8
  Andreas Singraber authored Mar 11, 2021
  
  5d0667c8
- Merge branch 'master' of ssh://gitlab.e-cam2020.eu:10022/e-cam/E-CAM-Library... · 6e579c0a
  Andreas Singraber authored Mar 11, 2021
```
Merge branch 'master' of ssh://gitlab.e-cam2020.eu:10022/e-cam/E-CAM-Library into n2p2_symfunc_param_generator
```
  6e579c0a
- Fixed spelling error · 61aaffc9
  Andreas Singraber authored Mar 11, 2021
  
  61aaffc9
- Fixed links in readme, added some build info · 55589485
  Andreas Singraber authored Mar 11, 2021
  
  55589485