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- ; source: https://lipidbook.org/package/show/id/152.html
- [moleculetype]
- ; molname nrexcl
- POPC 1
- [ atoms ]
- ; nr type resnr resid atom cgnr charge mass
- 1 Q0 1 POPC NC3 1 1.0000 72.0000
- 2 Qa 1 POPC PO4 2 -1.0000 72.0000
- 3 Na 1 POPC GL1 3 0.0000 72.0000
- 4 Na 1 POPC GL2 4 0.0000 72.0000
- 5 C1 1 POPC C1A 5 0.0000 72.0000
- 6 C1 1 POPC C2A 6 0.0000 72.0000
- 7 C1 1 POPC C3A 7 0.0000 72.0000
- 8 C1 1 POPC C4A 8 0.0000 72.0000
- 9 C1 1 POPC C1B 9 0.0000 72.0000
- 10 C1 1 POPC C2B 10 0.0000 72.0000
- 11 C3 1 POPC D3B 11 0.0000 72.0000
- 12 C1 1 POPC C4B 12 0.0000 72.0000
- 13 C1 1 POPC C5B 13 0.0000 72.0000
- [ bonds ]
- ;nums func ref fc
- 1 2 1 0.4730 1.2500e+03
- 2 3 1 0.4800 1.2500e+03
- 2 4 1 0.5130 1.2500e+03
- 3 4 1 0.4020 1.2500e+03
- 4 5 1 0.4700 1.2500e+03
- 5 6 1 0.4700 1.2500e+03
- 6 7 1 0.4700 1.2500e+03
- 7 8 1 0.4700 1.2500e+03
- 3 9 1 0.4700 1.2500e+03
- 9 10 1 0.4700 1.2500e+03
- 10 11 1 0.4700 1.2500e+03
- 11 12 1 0.4700 1.2500e+03
- 12 13 1 0.4700 1.2500e+03
- [ angles ]
- ;atoms func ref fc
- 2 3 9 2 180.0000 2.5000e+01
- 3 4 5 2 120 45
- 4 3 9 2 120 45
- 4 5 6 2 180.0000 2.5000e+01
- 5 6 7 2 180.0000 2.5000e+01
- 6 7 8 2 180.0000 2.5000e+01
- 3 9 10 2 180.0000 2.5000e+01
- 9 10 11 2 180.0000 2.5000e+01
- ; 10 11 12 2 120.0000 4.5000e+01
- 10 11 12 2 145.0000 4.5000e+01
- 11 12 13 2 180.0000 2.5000e+01
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