Publications

4 results for Helgi I. Ingolfsson

Machine learning–driven multiscale modeling reveals lipid-dependent dynamics of RAS signaling proteins
- - Helgi I. Ingolfsson
  - Chris Neale
  - et al.
- 2022
- PNAS
Paper
Generalizable Coordination of Large Multiscale Workflows: Challenges and Learnings at Scale
- - Harsh Bhatia
  - Francesco Di Natale
  - et al.
- 2021
- SC 2021
Conference paper
DdcMD: A fully GPU-accelerated molecular dynamics program for the Martini force field
- - Xiaohua Zhang
  - Shiv Sundram
  - et al.
- 2020
- Journal of Chemical Physics
Paper
A massively parallel infrastructure for adaptive multiscale simulations: Modeling RAS initiation pathway for cancer
- - Francesco Di Natale
  - Harsh Bhatia
  - et al.
- 2019
- SC 2019
Conference paper