Open gilleain opened 9 years ago
The reverse of converting an all-atom model to a topology, although obviously without any degree of accuracy. One use-case would be creating initial folds for further structure refinement.
A hard problem in general, but could be interesting to see.
The reverse of converting an all-atom model to a topology, although obviously without any degree of accuracy. One use-case would be creating initial folds for further structure refinement.
A hard problem in general, but could be interesting to see.