EXSCALATE: An extreme-scale in-silico virtual screening platform to evaluate 1 trillion compounds in 60 hours on 81 PFLOPS supercomputers.
Davide GadioliEmanuele VitaliFederico FicarelliChiara LatiniCandida ManelfiCarmine TalaricoCristina SilvanoCarlo CavazzoniGianluca PalermoAndrea Rosario BeccariPublished in: CoRR (2021)