Mercurial > repos > recetox > msmetaenhancer
comparison macros.xml @ 2:4ae5b466a805 draft
"planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/msmetaenhancer commit f09a5b3ee451d78dc025baee5eccb099f71be2b4"
author | recetox |
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date | Tue, 15 Feb 2022 12:26:04 +0000 |
parents | 4c328e0e59ab |
children | b48c57453a25 |
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1:4c328e0e59ab | 2:4ae5b466a805 |
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1 <macros> | 1 <macros> |
2 <token name="@TOOL_VERSION@">0.1.2</token> | 2 <token name="@TOOL_VERSION@">0.1.3</token> |
3 | 3 |
4 <xml name="creator"> | 4 <xml name="creator"> |
5 <creator> | 5 <creator> |
6 <person | 6 <person |
7 givenName="Matej" | 7 givenName="Matej" |
30 For detailed documentation of the tool please visit https://msmetaenhancer.readthedocs.io/. | 30 For detailed documentation of the tool please visit https://msmetaenhancer.readthedocs.io/. |
31 ]]> | 31 ]]> |
32 </token> | 32 </token> |
33 | 33 |
34 <xml name="job_options"> | 34 <xml name="job_options"> |
35 <option value="inchi canonical_smiles PubChem">PubChem: inchi -> canonical_smiles</option> | |
35 <option value="inchi formula PubChem">PubChem: inchi -> formula</option> | 36 <option value="inchi formula PubChem">PubChem: inchi -> formula</option> |
36 <option value="inchi inchikey PubChem">PubChem: inchi -> inchikey</option> | 37 <option value="inchi inchikey PubChem">PubChem: inchi -> inchikey</option> |
38 <option value="inchi isomeric_smiles PubChem">PubChem: inchi -> isomeric_smiles</option> | |
37 <option value="inchi iupac_name PubChem">PubChem: inchi -> iupac_name</option> | 39 <option value="inchi iupac_name PubChem">PubChem: inchi -> iupac_name</option> |
38 <option value="inchi smiles PubChem">PubChem: inchi -> smiles</option> | 40 <option value="name canonical_smiles PubChem">PubChem: name -> canonical_smiles</option> |
39 <option value="name formula PubChem">PubChem: name -> formula</option> | 41 <option value="name formula PubChem">PubChem: name -> formula</option> |
40 <option value="name inchi PubChem">PubChem: name -> inchi</option> | 42 <option value="name inchi PubChem">PubChem: name -> inchi</option> |
41 <option value="name inchikey PubChem">PubChem: name -> inchikey</option> | 43 <option value="name inchikey PubChem">PubChem: name -> inchikey</option> |
44 <option value="name isomeric_smiles PubChem">PubChem: name -> isomeric_smiles</option> | |
42 <option value="name iupac_name PubChem">PubChem: name -> iupac_name</option> | 45 <option value="name iupac_name PubChem">PubChem: name -> iupac_name</option> |
43 <option value="name smiles PubChem">PubChem: name -> smiles</option> | 46 <option value="casno inchikey CTS">CTS: casno -> inchikey</option> |
47 <option value="inchikey inchi CTS">CTS: inchikey -> inchi</option> | |
48 <option value="inchikey iupac_name CTS">CTS: inchikey -> iupac_name</option> | |
49 <option value="inchikey name CTS">CTS: inchikey -> name</option> | |
50 <option value="name inchikey CTS">CTS: name -> inchikey</option> | |
44 <option value="casno smiles CIR">CIR: casno -> smiles</option> | 51 <option value="casno smiles CIR">CIR: casno -> smiles</option> |
52 <option value="inchi smiles CIR">CIR: inchi -> smiles</option> | |
45 <option value="inchikey casno CIR">CIR: inchikey -> casno</option> | 53 <option value="inchikey casno CIR">CIR: inchikey -> casno</option> |
46 <option value="inchikey formula CIR">CIR: inchikey -> formula</option> | 54 <option value="inchikey formula CIR">CIR: inchikey -> formula</option> |
47 <option value="inchikey inchi CIR">CIR: inchikey -> inchi</option> | 55 <option value="inchikey inchi CIR">CIR: inchikey -> inchi</option> |
48 <option value="inchikey smiles CIR">CIR: inchikey -> smiles</option> | 56 <option value="inchikey smiles CIR">CIR: inchikey -> smiles</option> |
49 <option value="smiles inchikey CIR">CIR: smiles -> inchikey</option> | 57 <option value="smiles inchikey CIR">CIR: smiles -> inchikey</option> |
50 <option value="casno inchikey CTS">CTS: casno -> inchikey</option> | |
51 <option value="inchikey inchi CTS">CTS: inchikey -> inchi</option> | |
52 <option value="inchikey iupac_name CTS">CTS: inchikey -> iupac_name</option> | |
53 <option value="inchikey name CTS">CTS: inchikey -> name</option> | |
54 <option value="name inchikey CTS">CTS: name -> inchikey</option> | |
55 <option value="inchikey casno NLM">NLM: inchikey -> casno</option> | 58 <option value="inchikey casno NLM">NLM: inchikey -> casno</option> |
56 <option value="inchikey formula NLM">NLM: inchikey -> formula</option> | 59 <option value="inchikey formula NLM">NLM: inchikey -> formula</option> |
57 <option value="inchikey name NLM">NLM: inchikey -> name</option> | 60 <option value="inchikey name NLM">NLM: inchikey -> name</option> |
58 <option value="name casno NLM">NLM: name -> casno</option> | 61 <option value="name casno NLM">NLM: name -> casno</option> |
59 <option value="name formula NLM">NLM: name -> formula</option> | 62 <option value="name formula NLM">NLM: name -> formula</option> |