Dataset to reproduce MD simulations described in "An atomistic view of the YiiP structural changes upon zinc(II) binding"
| Main Authors: | Davide Sala, Andrea Giachetti, Antonio Rosato |
|---|---|
| Format: | info dataset Journal |
| Terbitan: |
, 2019
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| Subjects: | |
| Online Access: |
https://zenodo.org/record/2658142 |
Daftar Isi:
- Here are collected topologies, parameters, distance restraints, starting coordinates and trajectories for all the simulations reported in the manuscript entitled "An atomistic view of the YiiP structural changes upon zinc(II) binding"
- us = umbrella simulation