Commits · d0657c596179065c591a252e4991765a1299d8ed · Martin Kurečka / Plumed AlphaFold · GitLab

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May 09, 2016
- Small fix to Fourier transform and to finding of grid points on surface · d0657c59
  Gareth Tribello authored 8 years ago
  
  d0657c59
May 03, 2016
- Fixes to the manual given the new code · 0624bf76
  Gareth Tribello authored 8 years ago
  
  0624bf76
May 02, 2016
- Added method to calculate ensemble averages · 20cd869f
  Gareth Tribello authored 8 years ago
  
  20cd869f
- Started adding all the stuff for reweighting in an averaging base class · a8cfda16
  Gareth Tribello authored 8 years ago
  
  a8cfda16
- Added base class for creating grid and made everything involving grids inherits from here · 6dae14cc
  Gareth Tribello authored 8 years ago
  
  6dae14cc
Apr 07, 2016
- Put fixes to documentation from Edoardo Baldi into Fourier Transform routine · 89da01db
  Gareth Tribello authored 8 years ago
  
  89da01db
- Fixed bugs that appear without DNDEBUG · 0a482834
  Gareth Tribello authored 8 years ago
  
  0a482834
Apr 06, 2016
- Added functionality to fourier transform grids thanks Edoardo Baldi · 1b2c9df7
  Gareth Tribello authored 8 years ago
  
  1b2c9df7