QuBiLS-MAS Software

  1. Valdés-Martiní, J. R.; Marrero-Ponce, Y.; García-Jacas, C. R.; Martinez-Mayorga, K.; Barigye, S. J.; Vaz d‘Almeida, Y. S.; Pham-The, Hai.; Pérez-Giménez, F.; Morell, C. A. QuBiLS-MAS, open source multi-platform software for atom- and bond-based topological (2D) and chiral (2.5D) algebraic molecular descriptors computations. Journal of Cheminformatics. 2017, 9 (35), 1-26. DOI: 10.1186/s13321-017-0211-5

QuBiLS-MAS Applications

  1. Medina Marrero R.; Marrero-Ponce Y.; Barigye S. J.; Echeverría Díaz Y.; Acevedo-Barrios R.; Casañola-Martín G. M.; García Bernal M.; Torrens F.; Pérez-Giménez F. QuBiLs-MAS method in early drug discovery and rational drug identification of antifungal agents. SAR and QSAR in Environmental Research. 2015. 26 (11), 943-58. DOI: 10.1080/1062936X.2015.1104517