diff --git a/Project.toml b/Project.toml index b7df673..3e92809 100644 --- a/Project.toml +++ b/Project.toml @@ -4,9 +4,7 @@ authors = ["Anton Oresten"] version = "0.0.1" [deps] -AssigningSecondaryStructure = "8ed43e74-60fb-4e11-99b9-91deed37aef7" LinearAlgebra = "37e2e46d-f89d-539d-b4ee-838fcccc9c8e" -PDBTools = "e29189f1-7114-4dbd-93d0-c5673a921a58" [compat] julia = "1" diff --git a/src/BackBoner.jl b/src/BackBoner.jl index bde92af..4f80a48 100644 --- a/src/BackBoner.jl +++ b/src/BackBoner.jl @@ -2,8 +2,7 @@ module BackBoner using LinearAlgebra -import AssigningSecondaryStructure as ASS -export ASS +export BackBone include("backbone.jl") include("oxygen.jl") diff --git a/src/backbone.jl b/src/backbone.jl index fd44307..ba762e1 100644 --- a/src/backbone.jl +++ b/src/backbone.jl @@ -1,3 +1,5 @@ +export BackBone, atom_coord_matrix + """ Backbone{A, T} diff --git a/src/ncaco.jl b/src/ncaco.jl index ff7d634..abdded4 100644 --- a/src/ncaco.jl +++ b/src/ncaco.jl @@ -1,3 +1,5 @@ +export nitrogen_coord_matrix, alphacarbon_coord_matrix, carbon_coord_matrix, oxygen_coord_matrix + nitrogen_coord_matrix(bb::Backbone) = atom_coord_matrix(bb, 1) alphacarbon_coord_matrix(bb::Backbone) = atom_coord_matrix(bb, 2) carbon_coord_matrix(bb::Backbone) = atom_coord_matrix(bb, 3)