Table 5. Polarization Energies of Protein Droplet and Ionic Liquids.
system | ncp7 | ubiquitin | dhfr | [dmim+][Cl−] |
---|---|---|---|---|
ref | –24202.54 | –11154.87 | –28759.01 | –1476.79 |
ExPT | –27362.70 | –10919.77 | –28076.62 | –5841.73 |
TCG1 | –21733.63 | –9897.22 | –25583.50 | –1428.35 |
TCG2 | –23922.79 | –11031.67 | –28463.51 | –1420.00 |
TCG3 | –24262.87 | –11174.93 | –28812.99 | –1450.22 |
TPCG1 (P = diag) | –21438.14 | –9907.09 | –25588.07 | –1465.66 |
TPCG2 (P = diag) | –23613.31 | –10948.32 | –28206.73 | –1462.22 |
TPCG3 (P = diag) | –24219.49 | –11164.62 | –28775.53 | –1469.89 |
TPCG1 (P = Skeel) | –22489.55 | –10458.44 | –27030.86 | –1424.49 |
TPCG2 (P = Skeel) | –24056.53 | –11090.36 | –28637.35 | –1469.05 |
TPCG3 (P = Skeel) | –24208.22 | –11144.53 | –28763.55 | –1477.02 |