Commits · 0b7b9e1f5b6cef75dad9f9b67f39c8e7c155aa19 · Martin Kurečka / Plumed AlphaFold

Nov 20, 2020
- Regtest for ves_md_linearexpansion with shifted periodic potential · 0b7b9e1f
  Benjamin Pampel authored 4 years ago
  
  0b7b9e1f
Jan 23, 2020
- just remove failing file, it is not really needed for this regtest · fb0f0470
  Omar Valsson authored 5 years ago
  
  fb0f0470
- fixed failing regtest on travis · 0c330431
  Omar Valsson authored 5 years ago
  
  0c330431
- Make sure that output files are written out at the final step. Should fix... · a4e884da
  Omar Valsson authored 5 years ago
  
  Make sure that output files are written out at the final step. Should fix issues with restarting reported by @PabloPiaggi
  a4e884da
- Fixed an off-by-one error in output of target dist averages · 0469b548
  Omar Valsson authored 5 years ago
  
  0469b548
Jun 07, 2018
- Fixed a typo in keyword, thanks to @bpampel · 38325b9c
  Omar Valsson authored 6 years ago
  
  38325b9c
Jan 03, 2018
- regtest for fes proj · c32f536e
  Omar Valsson authored 7 years ago
  
  c32f536e
Jan 02, 2018
- Fixed problem with scaled legendre poly · 463d26db
  Omar Valsson authored 7 years ago
  
  463d26db
Dec 24, 2017
- Legender scaled 2D regtest · 70aed530
  Omar Valsson authored 7 years ago
  
  70aed530
- Regtest for Legendre scaled · 47857e3f
  Omar Valsson authored 7 years ago
  
  47857e3f
Dec 20, 2017
- Further regtests · f9da4e27
  Omar Valsson authored 7 years ago
  
  f9da4e27
- Regtests for MONITOR_AVERAGE_GRADIENT · 066ddc35
  Omar Valsson authored 7 years ago
  
  066ddc35
Dec 19, 2017
- Instantameous gradient not on by default · 12d8599e
  Omar Valsson authored 7 years ago
  
  12d8599e
Oct 01, 2017
- Changed the number of mpiprocs/walkers in mwalkers tests · 911a852b
  Omar Valsson authored 7 years ago
  
  911a852b
- Added VES code from other repo · fcd71e7f
  Omar Valsson authored 7 years ago
  
  fcd71e7f