OptAA3d: OptAA3d.sdf - 20 Amino Acids Optimized with MOE 2011.10...

Description Examples

Description

OptAA3d.sdf - 20 Amino Acids Optimized with MOE 2011.10 (Semiempirical AM1)

Examples

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# this operation requires the rcdk package
# require(rcdk)
# optaa3d = load.molecules(system.file("sysdata/OptAA3d.sdf", package = "protr"))
# view.molecule.2d(optaa3d[[1]])  # view the first AA

protr documentation built on May 18, 2019, 9:02 a.m.