Graph of MetaboCoreUtils
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  • fe9e294 (HEAD -> devel, origin/master, origin/devel, origin/HEAD) bump x.y.z version to odd y following creation of RELEASE_3_18 branch by J Wokaty <jennifer.wokaty@sph.cuny.edu> 2023-10-24 11:29:40 -0400;
  • 4c181cc (origin/RELEASE_3_18, RELEASE_3_18) bump x.y.z version to even y prior to creation of RELEASE_3_18 branch by J Wokaty <jennifer.wokaty@sph.cuny.edu> 2023-10-24 11:29:40 -0400;
  • 8514b68 docs: small updates and fixes by jorainer <johannes.rainer@gmail.com> 2023-10-02 10:48:04 +0200;
  • 95b1a38 Merge pull request <a href="#71">#71</a> from rformassspectrometry/phili by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2023-10-02 10:33:40 +0200;
  • bd8727e Update mclosest.R by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 16:04:12 +0200;
  • 1788f7e fix: description and examples by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 15:55:16 +0200;
  • 99237bb Create mclosest.Rd by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 13:50:53 +0200;
  • 497ca42 Update mclosest.R by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 13:26:08 +0200;
  • 5f90cdc Update test_mclosest.R by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 13:19:12 +0200;
  • e62c045 last update by Philippine Louail <philippine.louail@outlook.com> 2023-09-29 12:36:17 +0200;
  • 3b47167 Update mclosest.R by Philippine Louail <philippine.louail@outlook.com> 2023-09-27 14:19:57 +0200;
  • 0408089 Merge pull request <a href="#69">#69</a> from rformassspectrometry/jomain by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-27 10:21:32 +0200;
  • 3a880fe refactor: remove hits with difference larger than tolerance by jorainer <johannes.rainer@gmail.com> 2023-09-27 08:39:52 +0200;
  • 641c59c Merge branch 'phili' into jomain by jorainer <johannes.rainer@gmail.com> 2023-09-27 08:26:26 +0200;
  • c6f89a1 Update test_mclosest.R by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-26 15:48:01 +0200;
  • 02217ad fix: isotopologues to check for ordered m/z values by jorainer <johannes.rainer@gmail.com> 2023-09-25 08:22:54 +0200;
  • a410060 fix: vector output by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-18 16:36:10 +0200;
  • 16c687f added definition of function by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-18 16:23:37 +0200;
  • f0ff641 Update mclosest.R by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-15 10:03:09 +0200;
  • 56c131b Update mclosest.R by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-14 18:23:50 +0200;
  • 0fa498c Update mclosest.R by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-14 18:12:31 +0200;
  • d4a5daa Update mclosest.R by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-14 11:38:42 +0200;
  • 6b4d57a writing new function by Philippine Louail <127301965+philouail@users.noreply.github.com> 2023-09-13 18:24:40 +0200;
  • 04c11c8 tests: add unit test for containsElements and invalid elements as input by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-09 20:44:53 +0200;
  • 5e63c01 docs: update roxygen by jorainer <johannes.rainer@gmail.com> 2023-08-09 12:56:42 +0200;
  • f234089 Merge remote-tracking branch 'origin/main' by jorainer <johannes.rainer@gmail.com> 2023-08-09 12:54:59 +0200;
  • 8e2bb02 Merge remote-tracking branch 'upstream/devel' by jorainer <johannes.rainer@gmail.com> 2023-08-09 12:51:24 +0200;
  • 0888fa4 Merge pull request <a href="#65">#65</a> from rformassspectrometry/countElements by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-08 18:53:14 +0200;
  • 428fce7 chore: bump version number by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-08 18:44:20 +0200;
  • 7025d69 refactor: filter NA instead of NULL/empty strings by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-05 05:36:37 +0200;
  • 6d8ad2c refactor: countElements returns NA if an element is invalid instead of dropping it by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-04 22:31:32 +0200;
  • e95886f Merge pull request <a href="#62">#62</a> from rformassspectrometry/issue61-countElements-NA by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-04 14:53:16 +0200;
  • be69775 chore: bump version by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-04 14:44:50 +0200;
  • 9946107 refactor: return NA for given NA in {contains,subtract,add}Elements by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-02 20:32:17 +0200;
  • ca643a3 feat: accept NA in countElements; see <a href="#61">#61</a> by Sebastian Gibb <mail@sebastiangibb.de> 2023-08-01 21:08:30 +0200;
  • f61833f bump x.y.z version to odd y following creation of RELEASE_3_17 branch by J Wokaty <jwokaty@users.noreply.github.com> 2023-04-25 11:26:30 -0400;
  • 807b21b (origin/RELEASE_3_17, RELEASE_3_17) bump x.y.z version to even y prior to creation of RELEASE_3_17 branch by J Wokaty <jwokaty@users.noreply.github.com> 2023-04-25 11:26:30 -0400;
  • 7294eec docs: update README by jorainer <johannes.rainer@gmail.com> 2023-04-12 15:30:26 +0200;
  • b3134d5 ci: change branch name by jorainer <johannes.rainer@gmail.com> 2023-04-12 15:09:29 +0200;
  • d56229c Update readme by jorainer <johannes.rainer@gmail.com> 2023-04-05 07:46:31 +0200;
  • 3c27831 ci: update codecov badge by jorainer <johannes.rainer@gmail.com> 2023-03-15 10:27:13 +0100;
  • 4e6924d docs: add devel branch for codecov badge by jorainer <johannes.rainer@gmail.com> 2023-03-15 09:46:14 +0100;
  • b12834d Merge pull request <a href="#60">#60</a> from rformassspectrometry/jomain by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2023-03-10 07:56:49 +0100;
  • 1b87d39 ci: update branches by jorainer <johannes.rainer@gmail.com> 2023-03-10 07:55:10 +0100;
  • f231d09 bump x.y.z version to odd y following creation of RELEASE_3_16 branch by J Wokaty <jennifer.wokaty@sph.cuny.edu> 2022-11-01 11:23:55 -0400;
  • 5db2de6 (origin/RELEASE_3_16, RELEASE_3_16) bump x.y.z version to even y prior to creation of RELEASE_3_16 branch by J Wokaty <jennifer.wokaty@sph.cuny.edu> 2022-11-01 11:23:55 -0400;
  • 388e44d Merge pull request <a href="#58">#58</a> from rformassspectrometry/issue57-drop_zero_elements by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-08-26 15:16:52 +0200;
  • 0487647 refactor: drop elements with zero counts (fix #57) by Sebastian Gibb <mail@sebastiangibb.de> 2022-08-10 20:37:29 +0200;
  • 7329610 refactor: small fixes and changes by jorainer <johannes.rainer@gmail.com> 2022-04-29 16:41:27 +0200;
  • 062a74c Merge pull request <a href="#56">#56</a> from RogerGinBer/master by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-04-29 16:03:32 +0200;
  • 0e3d61b refactor: generalize .process_adduct_arg by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-28 12:22:26 +0200;
  • dcf91b2 Change adductFormula param by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-28 12:02:23 +0200;
  • 7be011b ci: use BioC 3.16 by jorainer <johannes.rainer@gmail.com> 2022-04-28 08:37:54 +0200;
  • 9cef0c0 bump x.y.z version to odd y following creation of RELEASE_3_15 branch by Nitesh Turaga <nitesh.turaga@gmail.com> 2022-04-26 16:12:39 +0000;
  • 594555c (origin/RELEASE_3_15, RELEASE_3_15) bump x.y.z version to even y prior to creation of RELEASE_3_15 branch by Nitesh Turaga <nitesh.turaga@gmail.com> 2022-04-26 16:12:39 +0000;
  • 169e4c8 Update test_adducts.R by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-26 12:41:29 +0200;
  • a50aec8 feat: add adductFormula function by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-12 16:58:39 +0200;
  • cdcd5ef Update chemFormula.R by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-12 12:42:21 +0200;
  • 3852a3f feat: add multiplyElements by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-12 11:25:22 +0200;
  • 97ca69d feat: Add formula2mz function <a href="#55">#55</a> by RogerGinBer <45530914+RogerGinBer@users.noreply.github.com> 2022-04-09 00:10:04 +0200;
  • 1a9f601 Merge pull request <a href="#54">#54</a> from rformassspectrometry/issue53-heavy-isotopes by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 12:16:07 +0100;
  • 4652879 tests: unit test for heavy isotopes by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:25:08 +0100;
  • 9db3fd7 docs: add an heavy isotope example by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:23:59 +0100;
  • a21e868 chore: bump version number by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:18:38 +0100;
  • b74ac02 feat: heavy isotopes support in pasteElements by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:18:23 +0100;
  • c90cd64 refactor: load isotopic mass instead of monoisotopic ones and resort according to Hill notion by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:15:11 +0100;
  • c12ea9e feat: support for heavy isotopes in countElements by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-11 11:12:44 +0100;
  • 0b56ba7 tests: add unit test for chemical element name validation by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-10 15:45:12 +0100;
  • 54f1ae1 tests: add unit tests for heavy isotopes in countElements by Sebastian Gibb <mail@sebastiangibb.de> 2022-03-10 15:44:46 +0100;
  • 81841f9 docs: fix references.bib file by jorainer <johannes.rainer@gmail.com> 2022-02-11 16:43:55 +0100;
  • bcce355 docs: add references section by jorainer <johannes.rainer@gmail.com> 2022-02-11 16:35:29 +0100;
  • 87d95a4 docs: update NEWS and add citation by jorainer <johannes.rainer@gmail.com> 2022-02-11 16:31:42 +0100;
  • 4c18c07 Merge pull request <a href="#52">#52</a> from meowcat/patch-1 by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-02-11 16:08:12 +0100;
  • 869a4ab Added meowcat as contributor by meowcat <Michael.Stravs@eawag.ch> 2022-02-11 15:14:53 +0100;
  • 05b1f1d Update test_chemFormula.R by meowcat <Michael.Stravs@eawag.ch> 2022-02-11 09:57:38 +0100;
  • 977b54e Update chemFormula.R, fixing <a href="#51">#51</a> by meowcat <Michael.Stravs@eawag.ch> 2022-02-11 09:51:32 +0100;
  • e3a622b fix: fix documentation and vignette by jorainer <johannes.rainer@gmail.com> 2022-02-09 13:11:44 +0100;
  • e2de7d3 Merge pull request <a href="#50">#50</a> from rformassspectrometry/michael_kendrick by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-02-09 12:58:34 +0100;
  • 35749fd correction function call by michaelwitting <michael.witting@helmholtz-muenchen.de> 2022-02-04 14:14:10 +0100;
  • e208ba1 updated functions, tests and documentation by michaelwitting <michael.witting@helmholtz-muenchen.de> 2022-02-04 13:56:53 +0100;
  • e7a0d03 fix: pkgdown url by jorainer <johannes.rainer@gmail.com> 2022-02-04 11:33:44 +0100;
  • 83d4c93 README: fix by jorainer <johannes.rainer@gmail.com> 2022-02-04 10:59:06 +0100;
  • cc6d15f README: add badges by jorainer <johannes.rainer@gmail.com> 2022-02-04 10:44:19 +0100;
  • dfbc2ad Update README by jorainer <johannes.rainer@gmail.com> 2022-02-04 09:30:44 +0100;
  • 6ce93d7 added functions to work with Kendrick mass defects, incl unit tests and vignette update by michaelwitting <michael.witting@helmholtz-muenchen.de> 2022-02-02 16:55:53 +0100;
  • 266132a tests: refactor onLoad tests by jorainer <johannes.rainer@gmail.com> 2022-01-25 14:21:30 +0100;
  • 94f64c3 tests: disable unit test for onLoad by jorainer <johannes.rainer@gmail.com> 2022-01-25 12:42:32 +0100;
  • 7549f6c tests: add missing unit tests by jorainer <johannes.rainer@gmail.com> 2022-01-25 11:56:29 +0100;
  • 9ef82c5 refactor: vectorize calculateMass by jorainer <johannes.rainer@gmail.com> 2022-01-03 10:34:44 +0100;
  • 01fc1aa Merge pull request <a href="#48">#48</a> from rformassspectrometry/michael_exactMass by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-01-03 10:00:15 +0100;
  • 32cb0b5 bump version by jorainer <johannes.rainer@gmail.com> 2022-01-01 08:45:08 +0100;
  • dda0553 Merge pull request <a href="#49">#49</a> from rformassspectrometry/vectorizeElements by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2022-01-01 08:39:27 +0100;
  • d3f2bd0 refactor: vectorize *Element functions by Sebastian Gibb <mail@sebastiangibb.de> 2021-12-28 16:24:16 +0100;
  • 472acb6 updated documentation by michaelwitting <michael.witting@helmholtz-muenchen.de> 2021-12-26 11:41:10 +0100;
  • 0cc5932 change function name by michaelwitting <michael.witting@helmholtz-muenchen.de> 2021-12-26 11:39:57 +0100;
  • 1b06e2b added calculation of exact mass by michaelwitting <michael.witting@helmholtz-muenchen.de> 2021-12-22 19:53:58 +0100;
  • a0ba1aa added calculation exact masses from formula by michaelwitting <michael.witting@helmholtz-muenchen.de> 2021-12-22 19:43:52 +0100;
  • 119357b docs: fix NEWS by jorainer <johannes.rainer@gmail.com> 2021-12-01 15:52:09 +0100;
  • 7581157 docs: update documentation, DESCRIPTION by jorainer <johannes.rainer@gmail.com> 2021-12-01 15:44:45 +0100;
  • 885495b Merge pull request <a href="#47">#47</a> from LiesaSalzer/master by Johannes Rainer <5506112+jorainer@users.noreply.github.com> 2021-12-01 15:27:53 +0100;