Publikationen in Zusammenarbeit mit Forschern von Centro Nacional de Supercomputación (2)

2020

  1. The CECAM electronic structure library and the modular software development paradigm

    The Journal of chemical physics, Vol. 153, Núm. 2, pp. 024117

2018

  1. Controlled manipulation of enzyme specificity through immobilization-induced flexibility constraints

    Applied Catalysis A: General, Vol. 565, pp. 59-67