This shows you the differences between two versions of the page.
mm:parameters:lipids [2013/08/05 17:58] joaocoimbra |
mm:parameters:lipids [2013/10/03 18:59] (current) joaocoimbra |
||
---|---|---|---|
Line 4: | Line 4: | ||
|:::| [[MM:parameters:lipids:Phosphatidylcholines (PC)]] | | |:::| [[MM:parameters:lipids:Phosphatidylcholines (PC)]] | | ||
|:::| [[MM:parameters:lipids:Phosphatidylethanolamines (PE)]] | | |:::| [[MM:parameters:lipids:Phosphatidylethanolamines (PE)]] | | ||
- | |:::| [[MM:parameters:lipids:DPLC(example page)]] | | ||
- | |:::| [[MM:parameters:lipids:Phospholipids(example)]] | | ||
|:::|| | |:::|| | ||
- | + | ### | |
- | The following charge parameters for 12 distinct phospholipids were determined, following an AMBER compatible approach. These parameters were validated by building a bilayer system for each phospholipid type and by comparing structural and dynamical values with experimental data available. When considering the DOPC phospholipid a good correlation with experimental available data was obtained. These parameters were obtained under the General Amber Force Field (GAFF) terminology and general parameters. | + | The following charge parameters for 12 distinct phospholipids were determined, following an AMBER compatible approach. These parameters were validated by building a bilayer system for each phospholipid type and by comparing structural and dynamical values with experimental available data. When considering the DOPC phospholipid a good correlation with experimental available data was obtained. These parameters were obtained under the General Amber Force Field (GAFF) terminology and general parameters. |
+ | ### |