Tasks | Driver | Status |
|---|
https://openforcefield.atlassian.net/wiki/spaces/FF/pages/2592604191/Further+sulf+on+amide+improvements | Pavan Behara (former) | |
Evaluating priors | Alexandra McIsaac | | Status |
|---|
| colour | GreenYellow |
|---|
| title | DoneIn Progress |
|---|
|
|
Torsion multiplicity | Meghan Osato (former), Jessica Maat (former), Pavan Behara (former), Brent Westbrook | |
Increasing dataset coverage | | |
Re-fitting improper dihedral parameters | | |
Filtering conformers for training | Alexandra McIsaac | | Status |
|---|
| colour | Yellow |
|---|
| title | Not startedIn progress |
|---|
|
|
Fitting torsions to small molecules | Alexandra McIsaac | | Status |
|---|
| colour | Yellow |
|---|
| title | Not startedin progress |
|---|
|
|
Building test suite for known problems | | |
Using Espaloma to discover areas to improve parameters | Brent Westbrook | |