From: re-TAMD: exploring interactions between H3 peptide and YEATS domain using enhanced sampling
System Name | Parameter c | Parameter k | Parameter h | Number of CVs | Numbers of atoms |
---|---|---|---|---|---|
(Å.kcal/mol) | (kcal/mol) | defining each CV | |||
TAMDYpt13 | 0.02 | 40 | 10 | 3 | 68 |
TAMDYpt7 | 0.02 | 30 | 10 | 2 | 60 |
TAMDYpt3 | 0.7 | 30 | 10 | 1 | 67 |