MiMiC: Multiscale Modeling in Computational Chemistry
oleh: Viacheslav Bolnykh, Jógvan Magnus Haugaard Olsen, Simone Meloni, Martin P. Bircher, Emiliano Ippoliti, Paolo Carloni, Paolo Carloni, Ursula Rothlisberger
| Format: | Article |
|---|---|
| Diterbitkan: | Frontiers Media S.A. 2020-03-01 |
Deskripsi
Subjek
molecular dynamics; QM/MM; DFT; HPC; multiscale simulations; computational chemistry