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. 2022 May 12;106(9-10):3465–3488. doi: 10.1007/s00253-022-11945-8

Table 5.

Bioinformatic tools and databases for SM study

S. no. Name Functions URL References
1. Secondary Metabolite Bioinformatics Portal (SMBP) Database catalog and links of bioinformatic tool for the secondary metabolite study http://www.secondarymetabolites.org Palazzotto and Weber (2018)
2. Antibiotics and Secondary Metabolite Analysis SHell (antiSMASH) Web application and autonomous tool (LINUX, MacOS and MS Windows) to mine and analyze BGCs; include genomic tools and a homology-based metabolic modeling pipeline http://antismash.secondarymetabolites.org. Blin et al. (2013)
3. Natural Product Domain Seeker (NaPDoS) Tool for the rapid detection and analysis of secondary metabolite genes to detect and classify KS and C domains http://napdos.ucsd.edu/run_analysis.html Ziemert et al. (2012)
4. NP.searcher Web application search tool (LINUX) to mine for PKS/NRPS BGCs http://dna.sherman.lsi.umich.edu/ Chavali and Rhee (2018)
5. Genes to natural products/prediction informatics for secondary metabolomes (GNP/PRISM) Cluster mining tool and analyze the pathway for PKS and NRPS

http://magarveylab.ca/gnp/#!/genome

http://magarveylab.ca/prism

Skinnider et al. (2017)
6. Secondary Metabolite Unknown Region Finder (SMURF) Tool to mine PKS/NRPS/terpenoid gene clusters in fungal genome www.jcvi.org/smurf/ Wang et al. (2016)
7. Cluster Finder Stand-alone tool (LINUX and MacOS) to detect BGCs with secondary metabolite gene clusters in genomic and metagenomic data https://github.com/petercim/ClusterFinder Chavali and Rhee (2018)
8. HMMER web server Identify ketosynthase domain and condensation domain encoding genes in genomic and metagenomic datasets http://hmmer.org/ Potter et al. (2018)
9. XCMS Metabolomic data processing algorithm tool to extract metabolic features from raw MS data and perform statistical analysis. https://xcmsonline.scripps.edu. Domingo-Almenara et al. (2018)
10. iSNAP Web tool which automatically identify metabolites in MS/MS data based on genomic data http://snap.cifr.ncsu.edu Baptista et al. (2022)
11. CLUsterSEquenceANalyzer (CLUSEAN) Web accessible database of PKS/NRPS BGCs and annotation pipeline for secondary metabolite biosynthetic gene clusters.

http://bioserv.pbf.hr/

http://csdb.bioserv.pbf.hr/

Chavali and Rhee (2018)
12. Minimum Information about a Biosynthetic Gene cluster (MIBiG) Web tool for annotations and metadata on biosynthetic gene clusters and their molecular products. https://mibig.secondarymetabolites.org/ Bian et al. (2020)
13. EvoMining approach Stand-alone tool for phylogenomic approach of cluster identification (https://github.com/nselem/evomining/wiki) Sélem-Mojica et al. (2019)
14. Integrative meta-analysis of expression data (INMEX) Web-based tool to support meta-analysis of multiple gene expression datasets http://www.inmex.ca Xia et al. (2013)
15. Metscape 2 Web tool for the analysis and visualization of metabolomics and gene expression data and visualize changes in the gene/metabolite data. http://metscape.ncibi.org Rosato et al. (2018)
16. Crux MS analysis toolkit that combine computational, machine learning and statistical methods for proteomics analysis https://crux.ms/ McIlwain et al. (2014)