@article{doi-e181912a12dc27ac,
  title = {Computational Applications in Secondary Metabolite Discovery (CAiSMD): an online workshop},
  author = {Fidele Ntie-Kang and Kiran K. Telukunta and Serge A. T. Fobofou and Victor Chukwudi Osamor and Samuel A. Egieyeh and Marilia Valli and Yannick Djoumbou-Feunang and Maria Sorokina and Conrad Stork and Neann Mathai and Paul Zierep and Ana L. Chávez-Hernández and Miquel Duran-Frigola and Smith B. Babiaka and Romuald Tematio Fouedjou and Donatus B. Eni and Simeon Akame and Augustine B. Arreyetta-Bawak and Oyere T. Ebob and Jonathan A. Metuge and Boris D. Bekono and Mustafa A. Isa and Raphael Onuku and Daniel M. Shadrack and Thommas M. Musyoka and Vaishali M. Patil and Justin J. J. van der Hooft and Vanderlan da Silva Bolzani and José L. Medina-Franco and Johannes Kirchmair and Tilmann Weber and Özlem Tastan Bishop and Marnix H. Medema and Ludger A. Wessjohann and Jutta Ludwig-Müller},
  journal = {Journal of Cheminformatics},
  year = {2021},
  volume = {13},
  number = {1},
  pages = {64},
  doi = {10.1186/s13321-021-00546-8},
  abstract = {AbstractWe report the major conclusions of the online open-access workshop “Computational Applications in Secondary Metabolite Discovery (CAiSMD)” that took place from 08 to 10 March 2021. Invited speakers from academia and industry and about 200 registered participants from five continents (Africa, Asia, Europe, South America, and North America) took part in the workshop. The workshop highlighted the potential applications of computational methodologies in the search for secondary metabolites (SMs) or natural products (NPs) as potential drugs and drug leads. During 3 days, the participants of this online workshop received an overview of modern computer-based approaches for exploring NP discovery in the “omics” age. The invited experts gave keynote lectures, trained participants in hands-on sessions, and held round table discussions. This was followed by oral presentations with much interaction between the speakers and the audience. Selected applicants (early-career scientists) were offered the opportunity to give oral presentations (15 min) and present posters in the form of flash presentations (5 min) upon submission of an abstract. The final program available on the workshop website (https://caismd.indiayouth.info/) comprised of 4 keynote lectures (KLs), 12 oral presentations (OPs), 2 round table discussions (RTDs), and 5 hands-on sessions (HSs). This meeting report also references internet resources for computational biology in the area of secondary metabolites that are of use outside of the workshop areas and will constitute a long-term valuable source for the community. The workshop concluded with an online survey form to be completed by speakers and participants for the goal of improving any subsequent editions.}
}