Commits · 640c538d039ed4da4dd88c79c8c2080f73a6bec6 · Martin Kurečka / Plumed AlphaFold

Browse files

May 08, 2019
- job names · 640c538d
  Giovanni Bussi authored May 08, 2019
  
  640c538d
- fix · ac0f8b58
  Giovanni Bussi authored May 08, 2019
  
  ac0f8b58
- fix · d0f8ce65
  Giovanni Bussi authored May 08, 2019
  
  d0f8ce65
- Fixed conda version · d5fbbc79
  Giovanni Bussi authored May 08, 2019
  
  d5fbbc79
- Small fixes · 9d72305d
  Giovanni Bussi authored May 08, 2019
  
  9d72305d
- Numpy is not required anymore as of v2.5.1 · 8799dc21
  Giovanni Bussi authored May 08, 2019
  
  8799dc21
- test upload · 338e01c7
  Giovanni Bussi authored May 08, 2019
  338e01c7
May 07, 2019
- Merge branch 'v2.5' into v2.5-conda · eb9d54ff
  Toni authored May 07, 2019
  
  eb9d54ff
- tentative release protocol for conda: build+upload when on pre-release test- OR tags · f9ce251e
  Toni authored May 07, 2019
  
  f9ce251e
- disable xdrfile · 6bdab184
  Toni authored May 07, 2019
  
  6bdab184
- random attempt to fix xdrfile · fd36371a
  Toni authored May 07, 2019
  
  fd36371a
- Merge branch 'v2.4' into v2.5 · 9a65b9fa
  carlocamilloni authored May 07, 2019
  
  9a65b9fa
- doc · 729ae122
  carlocamilloni authored May 07, 2019
  
  729ae122
- Merge branch 'v2.4' into v2.5 · 4d493312
  carlocamilloni authored May 07, 2019
  
  4d493312
- doc · d92fc5b1
  carlocamilloni authored May 07, 2019
  
  d92fc5b1
- CoordinationNumber: modified regtest to better check for derivatives · e0a37fed
  carlocamilloni authored May 07, 2019
  
  e0a37fed
- fixed derivatives in CoordinationNumbers (#471) · 5a12d49c
  MoleOrbitalHybridAnalyst authored May 07, 2019
  5a12d49c
May 02, 2019
- lgtm fix · f57398fd
  carlocamilloni authored May 02, 2019
  
  f57398fd
- Fixed files martiniFormFactor (#473) · 9069ece7
  cristinapaissoni authored May 02, 2019
  
  9069ece7
- doc · 2b7d4a1b
  carlocamilloni authored May 02, 2019
  
  2b7d4a1b
May 01, 2019
- changelog · a7e8acd7
  Giovanni Bussi authored May 01, 2019
  
  a7e8acd7
- fix #469 · fb681c9a
  Giovanni Bussi authored May 01, 2019
  fb681c9a
Apr 30, 2019
- docs · 90fbde2f
  carlocamilloni authored Apr 30, 2019
  
  90fbde2f
- SAXS: LGTM · 7849e121
  carlocamilloni authored Apr 30, 2019
  
  7849e121
- Metainference: doc · 056b8936
  carlocamilloni authored Apr 30, 2019
  
  056b8936
Apr 27, 2019
- typo · 67d3d2c5
  Giovanni Bussi authored Apr 27, 2019
  
  67d3d2c5
- Adding names to travis jobs · 21892632
  Giovanni Bussi authored Apr 27, 2019
  
  21892632
- Updated python readme · 27f07d37
  Giovanni Bussi authored Apr 27, 2019
  
  27f07d37
Apr 24, 2019
- Merge remote-tracking branch 'origin/v2.5' into v2.5-ves-lepton-fixes · 7c0f395f
  Omar Valsson authored Apr 24, 2019
  
  7c0f395f
- changed changelog slightly · bb0bbb6d
  Omar Valsson authored Apr 24, 2019
  
  bb0bbb6d
- changelog for VES lepton fixes · 90e7cc54
  Omar Valsson authored Apr 24, 2019
  
  90e7cc54
- lepton performance fixes for TD_CUSTOM · a3a1754c
  Omar Valsson authored Apr 24, 2019
  
  a3a1754c
- lepton performance fixes for BF_CUSTOM · ebef6841
  Omar Valsson authored Apr 24, 2019
  
  ebef6841
Apr 17, 2019
- doc · 51095a99
  carlocamilloni authored Apr 17, 2019
  
  51095a99
- gromacs 2019.2 · dbde245b
  carlocamilloni authored Apr 17, 2019
  
  dbde245b
- gromacs 2019.2 · 36ec3759
  carlocamilloni authored Apr 17, 2019
  
  36ec3759
Apr 16, 2019
- SAXS: arrayfire was defining an array before chosing a device · 134d25d9
  carlocamilloni authored Apr 16, 2019
  
  134d25d9
Apr 15, 2019
- doc: new GMX2019 · 3f23e1da
  carlocamilloni authored Apr 15, 2019
  3f23e1da
Apr 13, 2019
- gmx2019.1 patch cleaned · dc74333c
  carlocamilloni authored Apr 13, 2019
  dc74333c
- gmx2019: now it compiles but I tested only · e9dae359
  carlocamilloni authored Apr 13, 2019
  e9dae359