cheminfo/mass-tools

Issues

• `peptideToMf` should allow peptide with less than three letters

  #206 opened 2 months ago by targos
  0

• dependency cycle

  #70 opened 3 years ago by targos
  0

• Add `--coverage` back

  #197 opened 3 months ago by targos
  0

• Update svgdom / svg.js fails

  #73 opened 3 months ago by lpatiny
  3

• Update `svgdom`

  #193 opened 3 months ago by targos
  0

• Update `ml-fcnnls`

  #192 opened 3 months ago by targos
  0

• Problem using the library in safari

  #69 opened 3 months ago by lpatiny
  4

• Upgrade `@orama/orama`

  #191 opened 3 months ago by targos
  0

• Investigate lerna-Nx to improve running tasks

  #190 opened 3 months ago by targos
  0

• ms-spectrum npm package is big

  #183 opened 5 months ago by stropitek
  1

• bug: applyOneReactantReactions

  #160 opened 10 months ago by RicardoSilvestr
  1

• Function reactionFragmentation

  #126 opened a year ago by RicardoSilvestr
  1

• Publish new version of `emdb`

  #137 opened a year ago by targos
  2

• (octochem): add taxonomies search in activeOrNaturalSummerizer

  #118 opened a year ago by RicardoSilvestr
  1

• Add aromaticity index

  #107 opened 2 years ago by lpatiny
  1

• Create a method to give a similarity for 2 spectra

  #84 opened 2 years ago by lpatiny
  1

• Library doesn't know about element label T (tritium)

  #100 opened 2 years ago by targos
  1

• `mf-from-google-sheet` should not depend on `request`

  #89 opened 2 years ago by targos
  0

• breaking change in patch release of mf-generator

  #72 opened 3 years ago by targos
  3

• Can not publish with lerna

  #20 opened 4 years ago by lpatiny
  3

• Find fragmentation contribution for each bond hose

  #50 opened 3 years ago by lpatiny
  1

• Define rules to apply for in silico fragmentation

  #47 opened 3 years ago by lpatiny
  1

• Create HOSE code like for bond fragmentation (1 bond and 2 bonds)

  #49 opened 3 years ago by lpatiny
  0

• Create database with experimental data + molfile

  #48 opened 3 years ago by lpatiny
  0

• Create algorithm for in-silico fragmentation

  #46 opened 3 years ago by lpatiny
  0

• Find database of experimental data + structure

  #45 opened 3 years ago by lpatiny
  0

• Update spectrum-generator in isotopic-distribution

  #41 opened 3 years ago by targos
  0

• Import list of masses to create EICs

  #26 opened 3 years ago by jdesport
  2

• Report EICs characteristics

  #29 opened 3 years ago by jdesport
  0

• NO3-- not working

  #5 opened 5 years ago by lpatiny
  0

• Hill MF convention

  #3 opened 5 years ago by lpatiny
  0

• Load ChemBL and SureChemBL

  #2 opened 6 years ago by lpatiny
  0