NUS-HU Bilateral Workshop

Jan. 6-10, 2025 // Foyer, CSMB Research Building

9:00	Introduction to ab initio molecular dynamics and DFT Giulia Galli, University of Chicago, Pritzker School of Molecular Engineering, USA Francois Gygi, University of California Davis, USA
11:00	Coffee break at IRIS Adlershof
11:15	Introduction to advanced sampling methods Juan de Pablo, University of Chicago, Pritzker School of Molecular Engineering, USA Ludwig Schneider, University of Chicago, Pritzker School of Molecular Engineering, USA
13:15	Lunch break at IRIS Adlershof
14:30	Hands-on: Introduction to QBox Francois Gygi, University of California Davis, USA Arpan Kundu, University of Chicago, Pritzker School of Molecular Engineering, USA
15:30	Hands-on: Introduction to SSAGES Pablo Zubieta, University of Chicago, Pritzker School of Molecular Engineering, USA Ludwig Schneider, University of Chicago, Pritzker School of Molecular Engineering, USA
16:30	Coffee break at IRIS Adlershof
16:45	Hands-on: Coupling of ab initio and advanced sampling techniques Elizabeth M.Y. Lee, University of Chicago, Pritzker School of Molecular Engineering, USA Gustavo Perez, University of Chicago, Pritzker School of Molecular Engineering, USA
18:00	BBQ @ Gerdans, Erwin Schrödinger-Zentrum