Table 3. Weights of Observables wo and System Specific Observable Weights wo,s for Optimization Run 1.
observable | w0 | wo,DPSM128 | wo,DPSM256 | wo,POPC SSM CHOL |
---|---|---|---|---|
bond length dist | 1 | 1 | 0 | 1 |
angle dist | 100 | 1 | 0 | 1 |
dHH | 500 | 1 | 0 | 0.25 |
APL | 1000 | 1 | 0 | 0.25 |
Tm | 250 | 0 | 1 | 0 |
RDF COM DPSM-CHOL | 1 | 0 | 0 | 1 |