xMSannotator released /Archive/xMSannotator_1.3.2.tar.gz

xMSannotator released /Archive/xMSannotator_1.3.2.zip

xMSannotator released /Installation_instructions_xMSannotator_v1.3.2.txt

xMSannotator released /xmsPANDA_v1.0.6.85.R

xMSannotator released /Examples/Experiment2_featuretable.txt

xMSannotator released /Examples/Experiment1_featuretable.txt

xMSannotator released /Examples/Experiment1_HMDBIDs_95stdmix.csv

xMSannotator released /CustomDatabases/FooDB_2017_06_29.csv

xMSannotator released /CustomDatabases/hmdb4.0_2017-07-23.csv

David Sharpe posted a comment on discussion General Discussion

Hi, The SOAP APIs that are used to get data from ChemSpider have been retired, there are new APIs that replace the SOAP APIs and are described at https://developer.rsc.org. There is a short example of using the new APIs in an R script here: https://www.linkedin.com/pulse/getting-started-chemspider-apis-using-knime-r-php-david-schiessel?articleId=6444233959156121600#comments-6444233959156121600&trk=prof-post If you have any questions or need any help please contact the support team at api-at-rsc.org....

xMSannotator released /xMSannotator_1.3.2.tar.gz

xMSannotator released /xMSannotator_1.3.2.zip

xMSannotator released /PreviousVersions/xMSannotator_1.2.1.tar.gz

xMSannotator released /PreviousVersions/xMSannotator_1.2.1.zip

xMSannotator released /xMSannotator_1.3.1.tar.gz

xMSannotator released /xMSannotator_1.3.1.zip

xMSannotator released /Archive/xMSannotator_1.2.1.tar.gz

xMSannotator released /Archive/xMSannotator_1.2.1.zip

xMSannotator released /xMSannotator-manual.pdf

xMSannotator released /xMSannotator_1.3.1.tar.gz

xMSannotator released /xMSannotator_1.3.1.zip

xMSannotator released /Archive/xMSannotator_1.2.1.tar.gz

xMSannotator released /Archive/xMSannotator_1.2.1.zip

xMSannotator released /Examples/get_mz_by_KEGG_IDs_example.R

xMSannotator released /Examples/Multilevelannotation_with_confidence_levels_HMDB_example.R

xMSannotator released /Examples/Multilevelannotation_with_confidence_levels_Custom_database_example.R

xMSannotator released /CustomDatabases/PathMet1_KEGG_or_SMPDB_pathway_metabolites.csv

xMSannotator released /CustomDatabases/PathMet3_KEGG_human_pathway_metabolites.csv

xMSannotator released /CustomDatabases/PathMet2_SMPDB_pathway_metabolites.csv

xMSannotator released /CustomDatabases/ReadMe.xlsx

xMSannotator released /CustomDatabases/LitMet_metabolites.csv

xMSannotator released /CustomDatabases/IROA_metabolites.csv

xMSannotator released /CustomDatabases/SMPDB_pathway_metabolites.csv

xMSannotator released /CustomDatabases/hmdb_all_with_other_info.csv

xMSannotator released /CustomDatabases/KEGG_human_pathway_metabolites.csv

xMSannotator released /CustomDatabases/RefMet_metabolites.csv

xMSannotator released /CustomDatabases/KEGG_or_SMPDB_pathway_metabolites.csv

xMSannotator released /xMSannotator-manual.pdf

xMSannotator released /xMSannotator_1.2.1.tar.gz

xMSannotator released /xMSannotator_1.2.1.zip

xMSannotator released /Sample_input/Example_input_data_table.txt

xMSannotator released /Sample_output/Stage5_annotation_results.html

xMSannotator released /Sample_output/Stage1.csv

xMSannotator released /Sample_output/Stage2.csv

xMSannotator released /Sample_output/Stage4.csv

xMSannotator released /Sample_output/Stage5.csv

xMSannotator released /Sample_output/Stage2_withisotopes.txt

xMSannotator released /Sample_output/Readme.txt

xMSannotator released /Sample_output/Stage3.csv

xMSannotator released /xMSannotator_1.1.1.zip

xMSannotator released /xMSannotator_1.1.1.tar.gz

xMSannotator released /Examples/Example_input_data_table.txt

xMSannotator released /xMSannotator_1.1.zip

xMSannotator released /xMSannotator_1.1.tar.gz

xMSannotator released /xMSannotator-manual.pdf

xMSannotator released /xMSannotator_1.1.zip

xMSannotator released /xMSannotator_1.1.tar.gz

xMSannotator released /Examples/T3DBAnnotation_mz_search_example.R

xMSannotator released /Examples/HMDBAnnotation_mz_search_example.R

xMSannotator released /Examples/LipidMapsAnnotation_mz_search_example.txt

xMSannotator released /Examples/KEGGAnnotation_mz_search_example.R

xMSannotator released /Examples/Multilevelannotation_example.R

xMSannotator released /Examples/HMDBannotation_example.R

xMSannotator released /xMSannotator_1.1.zip

xMSannotator released /Installation_instructions_xMSannotator.txt

xMSannotator released /Examples/HMDBannotation_example.R

xMSannotator released /Examples/Multilevelannotation_example.R

xMSannotator released /xMSannotator-manual.pdf

xMSannotator released /Examples/get_mz_by_kegg_species_example.R

xMSannotator released /Examples/get_mz_by_pathwayIDs_example.R

xMSannotator released /Examples/HMDBannotation_example.R

xMSannotator released /Examples/get_mz_by_compoundIDs_example.R

xMSannotator released /Examples/get_kegg_map_example.R

xMSannotator released /xMSannotator_1.1.tar.gz