Commits · 6f3fd373531b49b5701b4c0e7bf8de228c820018 · Martin Kurečka / Plumed AlphaFold

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Dec 17, 2018
- fixed regtests · 6f3fd373
  Giovanni Bussi authored Dec 17, 2018
  6f3fd373
- Fix: Segmentation fault whenever more than 2 CVs are used for METAD with REWEIGHTING_NGRID #328 · 4f709055
  fiskissimo authored Oct 17, 2018
  4f709055
Dec 11, 2018
- changelog · 8483822e
  Giovanni Bussi authored Dec 11, 2018
  
  8483822e
- Fixed memory leak · 04cae903
  Giovanni Bussi authored Dec 11, 2018
  04cae903
Dec 07, 2018
- changelog · 31520cec
  Giovanni Bussi authored Dec 07, 2018
  
  31520cec
- Using functions to make sure initialization order is correct · 0602373a
  Giovanni Bussi authored Dec 07, 2018
  
  0602373a
- Tentative fix for conda build · 25cbe1c0
  Giovanni Bussi authored Dec 06, 2018
  25cbe1c0
- Comment on virial bug (see #414) · 1a4c2255
  Giovanni Bussi authored Dec 07, 2018
  
  1a4c2255
- changelog · 6365c1a5
  Giovanni Bussi authored Dec 07, 2018
  6365c1a5
- small fix in testing C/Fortran static linking · 133537a1
  Giovanni Bussi authored Nov 07, 2018
  133537a1
- user docs fixes · 601553cc
  carlocamilloni authored Oct 15, 2018
  
  601553cc
- OSX + homebrew + MPI constantly failes on travis, I make it not compulsory · 3a5d2125
  Giovanni Bussi authored Nov 07, 2018
  
  3a5d2125
- fixed warning · 65eb5a92
  Giovanni Bussi authored Nov 29, 2018
  
  65eb5a92
- Small fix in LDFLAGS when doing coverage · d14decf2
  Giovanni Bussi authored Oct 08, 2018
  d14decf2
- fixed · 5f40f5a4
  carlocamilloni authored Dec 07, 2018
  
  5f40f5a4
- MultiColvar: improve openmp performance · 0a82d573
  carlocamilloni authored Dec 07, 2018
  
  0a82d573
Dec 06, 2018
- v2.3: preparation for new (latest) version · d02ae642
  carlocamilloni authored Dec 06, 2018
  
  d02ae642
Dec 05, 2018
- Fix an OpenMP performace regression for Coordination and all multicolvar · 5be3b48f
  carlocamilloni authored Dec 05, 2018
  
  5be3b48f
Nov 27, 2018
- CS2Backbone: backported a fix for more than 2 chains · 87930377
  carlocamilloni authored Nov 27, 2018
  
  87930377
Oct 16, 2018
- User-doc: fix · b97ef89a
  carlocamilloni authored Oct 16, 2018
  
  b97ef89a
Oct 15, 2018
- Note on bug in puckering 6m · 468cdd42
  Giovanni Bussi authored Oct 15, 2018
  
  468cdd42
Oct 14, 2018
- OpenMP: more or equal the defined value · 4561e11b
  carlocamilloni authored Oct 14, 2018
  
  4561e11b
- OpenMP: if the number is less than the one · 6ee3b2e3
  carlocamilloni authored Oct 14, 2018
  6ee3b2e3
Oct 13, 2018
- Update ActionWithValue.cpp · cd81d2c8
  Carlo Camilloni authored Oct 13, 2018
  
  cd81d2c8
- OpenMP: fix for getGoodNumThread · dc2d61eb
  carlocamilloni authored Oct 13, 2018
  dc2d61eb
Oct 12, 2018
- OpenMP: clearDeriv using standardNUM of openMP thread · 3bf96924
  carlocamilloni authored Oct 12, 2018
  
  3bf96924
Oct 10, 2018
- removed USE_ALL_DATA from examples · 623fc970
  carlocamilloni authored Oct 10, 2018
  623fc970
- histogram: fix example · 255eac7d
  carlocamilloni authored Oct 10, 2018
  
  255eac7d
Oct 05, 2018
- Release v2.3.7 · 42cc8a8f
  Giovanni Bussi authored Oct 05, 2018
  
  42cc8a8f
- not maintained · 5ef37433
  Giovanni Bussi authored Oct 05, 2018
  
  5ef37433
- Travis tests for v2.3.7 · 1956b376
  Giovanni Bussi authored Oct 05, 2018
  
  1956b376
Sep 28, 2018
- changed order of sentences in readme · ac787cd4
  Giovanni Bussi authored Sep 28, 2018
  ac787cd4
Sep 04, 2018
- Fixed missing implicit arg for Plumed::gcmd() · f27a9a61
  Giovanni Bussi authored Sep 04, 2018
  
  f27a9a61
Jul 20, 2018
- changelog · 16e221e1
  Giovanni Bussi authored Jul 20, 2018
  
  16e221e1
- small fix in DUMPMASSCHARGE · 09bc529e
  Giovanni Bussi authored Jul 20, 2018
  09bc529e
Jul 17, 2018
- changelog · dd68b5c1
  Giovanni Bussi authored Jul 17, 2018
  
  dd68b5c1
- commit fix · ba752d90
  Giovanni Bussi authored Jul 17, 2018
  ba752d90
Jul 13, 2018
- added note on Intel MPI · 922edd7b
  Giovanni Bussi authored Jul 13, 2018
  
  922edd7b
- Fixed doc · 772408d7
  Giovanni Bussi authored Jul 13, 2018
  772408d7
Jul 12, 2018
- Update pushdoc · 923de6b8
  Giovanni authored Jul 12, 2018
  923de6b8

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Commits · 6f3fd373531b49b5701b4c0e7bf8de228c820018