A collection of topologies developed for molecular dynamics simulations using the MARTINI CG force field, http://cgmartini.nl/.
./LID_ET_LA_topologies
- ethanol
- lidocaine
- linoleic acid
https://doi.org/10.3390/membranes11060410
./SMA_martini
- Styrene-maleic acid copolymer (SMA)
https://doi.org/10.1021/acs.langmuir.8b03978
./DIBMA
- Diisobutylene-maleic acid copolymer (DIBMA)
https://doi.org/10.1016/j.bbamem.2020.183207
https://doi.org/10.3390/ijms22052548
./doxyl_lipids
Spin-labeled PC lipids:
- 1-palmitoyl-2-stearoyl-(5-doxyl)-sn-glycero-3-phosphocholine (16:0-5 doxyl PC)
- 1-palmitoyl-2- stearoyl-(12-doxyl)-sn-glycero-3-phosphocholine (16:0–12 doxyl PC)
- 1-palmitoyl-2-stearoyl-(16-doxyl)-sn-glycero-3-phosphocholine (16:0–16 doxyl PC)
https://doi.org/10.1016/j.bbamem.2020.183207
./phthalocyanine_martini2
- cationic photoantimicrobial phthalocyanine
https://doi.org/10.1021/acs.jpcb.7b11707
./antiseptics
- OCT, octenidine
- PIC, picloxydine
- MIR, miramistin
- CHL, chlorhexidine
https://dx.doi.org/10.1021/acs.jpcb.0c07212