Phytochemicals
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- Last Updated: Wednesday, 19 November 2014 14:31
Phytochemicals Initial structures for the five phytochemicals: capsaicin (cap), curucmin (cur), epigallocatechin gallate (EGCG), genistein (gen), and resveratrol (res); and those five phytochemicals in a POPC bilayer (512 POPC lipids, 6000 CG waters, and 48 phytochemicals each) simulated for 2 μs.
cap-CG.gro
cur-CG.gro
EGCG-CG.gro
gen-CG.gro
res-CG.gro
POPC-cap-2us.gro
POPC-cur-2us.gro
POPC-EGCG-2us.gro
POPC-gen-2us.gro
POPC-res-2us.gro
And the phytochemicals parameter file: