Thursday, June 29, 2023 |
Time(PDT) |
Topic |
Instructor |
8:00 am - 9:00 am |
Introduction and logistics |
Aiichiro Nakano |
9:00 am - 10:00 am |
Molecular dynamics simulation basics |
Priya Vashishta |
10:00 am - 11:00 am |
Reactive molecular dynamics basics |
Ken-ichi Nomura |
11:00 am - 12:00 pm |
Lunch break |
|
12:00 pm - 1:30 pm |
Reactive molecular dynamics hands on: RXMD code |
Nitish Baradwaj, Ruru Ma, Tian Sang, Pranab Sarker, Hind Aljaddani |
1:30 pm - 2:30 pm |
Machine learning basics |
Ken-ichi Nomura |
Friday, June 30, 2023 |
Time(PDT) |
Topic |
Instructor |
8:00 am - 10:00 am |
Machine learning hands-on |
Anikeya Aditya, Nitish Baradwaj, Taufeq Razakh, Liqiu Yang |
10:00 am - 11:00 am |
Quantum molecular dynamics basics |
Aiichiro Nakano |
11:00 am - 12:00 pm |
Lunch break |
|
12:00 pm - 1:30 pm |
Quantum molecular dynamics hands-on: QXMD code |
Anikeya Aditya, Ayu Irie, Himani Mishra, Liqiu Yang, Jingxin Zhang |
1:30 pm - 2:30 pm |
Quantum computing basics and hands-on |
Aiichiro Nakano |
Saturday, July 1, 2023 |
Time(PDT) |
Topic |
Instructor |
9:00 am - 11:00 am |
Participant presentations |
Workshop Attendees |
11:00 am - 11:15 am |
Closing remarks |
Pratibha Dev, Tao Wei |