Commits · 1171764be486dfd4ba72c6e43803fa8e1ce0d96c · Packages / chemical_checker · GitLab

25 Jan, 2021 10 commits
- script to add metadata to all reference h5 signatures · 1171764b
  nsoler authored Jan 25, 2021
  
  1171764b
- script to add metadata to all reference h5 signatures · 8417a46b
  nsoler authored Jan 25, 2021
  
  8417a46b
- script to add metadata to all reference h5 signatures · 3531b67d
  nsoler authored Jan 25, 2021
  
  3531b67d
- script to add metadata to all reference h5 signatures · 5422cd24
  nsoler authored Jan 25, 2021
  
  5422cd24
- script to add metadata to all reference h5 signatures · 3b5ed174
  nsoler authored Jan 25, 2021
  
  3b5ed174
- script to add metadata to all reference h5 signatures · bedda5bf
  nsoler authored Jan 25, 2021
  
  bedda5bf
- Merge branch 'master' of http://gitlabsbnb.irbbarcelona.org/packages/chemical_checker · 703c5d9b
  nsoler authored Jan 25, 2021
  
  703c5d9b
- script to add metadata to all reference h5 signatures · d5669642
  nsoler authored Jan 25, 2021
  
  d5669642
- comment · 434e33ae
  Martino Bertoni authored Jan 25, 2021
  
  434e33ae
- fix log · f4153701
  Martino Bertoni authored Jan 25, 2021
  
  f4153701
22 Jan, 2021 1 commit
- fixed problems with string dtype in base.py · 7902315a
  nsoler authored Jan 22, 2021
  
  7902315a
21 Jan, 2021 1 commit
- latest fixes while working on Microbiota · 4996947e
  nsoler authored Jan 21, 2021
  
  4996947e
20 Jan, 2021 2 commits
- fixed: b'' instead of string were coming out of the sanitizer for keys, keys_raw and features · 041abab1
  nsoler authored Jan 20, 2021
  
  041abab1
- fixed: b'' instead of string were coming out of the sanitizer for keys, keys_raw and features · 7c2b9fa9
  nsoler authored Jan 20, 2021
  
  7c2b9fa9
19 Jan, 2021 5 commits
- small change · df67a8e9
  nsoler authored Jan 19, 2021
  
  df67a8e9
- Fixed the 'overwrite' parameter in sign0.fit · 617faa73
  nsoler authored Jan 19, 2021
  
  617faa73
- Fixed the 'overwrite' parameter in sign0.fit · 9b6acf8f
  nsoler authored Jan 19, 2021
  
  9b6acf8f
- Fixed the 'overwrite' parameter in sign0.fit · 127d3f82
  nsoler authored Jan 19, 2021
  
  127d3f82
- Made a test_connection function to avoid error in standalone mode · 2bed08d6
  nsoler authored Jan 19, 2021
  
  2bed08d6
18 Jan, 2021 21 commits
- Merge branch 'master' of http://gitlabsbnb.irbbarcelona.org/packages/chemical_checker · d3890da7
  nsoler authored Jan 18, 2021
  
  d3890da7
- we need to deactivate some portion of the code for users · 6fa6e68a
  nsoler authored Jan 18, 2021
  
  6fa6e68a
- fixed unittest · 57f77d20
  Martino Bertoni authored Jan 18, 2021
  
  57f77d20
- bugfix in singularity recipe · 3d71b85e
  Martino Bertoni authored Jan 18, 2021
  
  3d71b85e
- fixed loading of confidence model · bb321aee
  Martino Bertoni authored Jan 18, 2021
  
  bb321aee
- faiss from pip instad of conda · bc315d59
  Martino Bertoni authored Jan 18, 2021
  
  bc315d59
- updated to tf2.3 · 2df20b03
  Martino Bertoni authored Jan 18, 2021
  
  2df20b03
- tuned sign3 params · 9fc2c2c6
  Martino Bertoni authored Jan 18, 2021
  
  9fc2c2c6
- reverted to h5py2 syntax · 04c3ece5
  Martino Bertoni authored Jan 18, 2021
  
  04c3ece5
- sharing the generator to avoid reading matrix in memory too many times · 1e0141b3
  Martino Bertoni authored Jan 07, 2021
  
  1e0141b3
- if confidence is not trained, train it · 6f209b99
  Martino Bertoni authored Jan 07, 2021
  
  6f209b99
- added try except on plotting · ff56799f
  Martino Bertoni authored Jan 07, 2021
  
  ff56799f
- h5py fix, mask as indeces not bools · 780cf1da
  Martino Bertoni authored Jan 04, 2021
  
  780cf1da
- avoid reading whole matrix everytime in find_lr · f2240ab5
  Martino Bertoni authored Jan 04, 2021
  
  f2240ab5
- h5py fix now masks must be indexes · b32b700b
  Martino Bertoni authored Jan 04, 2021
  
  b32b700b
- saving niverse inchi to inchikey mapping · b10a3255
  Martino Bertoni authored Jan 04, 2021
  
  b10a3255
- saving opt_t if not aleady saved · 991892c3
  Martino Bertoni authored Jan 04, 2021
  
  991892c3
- lazy loading of opt_t · 2294e853
  Martino Bertoni authored Jan 04, 2021
  
  2294e853
- major fix and speedup · f5c69b8b
  Martino Bertoni authored Dec 30, 2020
  
  f5c69b8b
- we dont want to load the module along with cc objects · d4c8166f
  Martino Bertoni authored Dec 30, 2020
  
  d4c8166f
- returns tring not bytes · 35892fee
  Martino Bertoni authored Dec 30, 2020
  
  35892fee