class Conformer

Defined in:

moltiverse/prepare.cr

Constructors

Instance Method Summary

Constructor Detail

def self.new(input_pdb : String, input_topology : String, min_steps : Int32) #

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Instance Method Detail

def basename : String #

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def coordinates_file : String #

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def min_steps : Int32 #

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def pdb_system : String #

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def structure : Chem::Structure #

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def topology_file : String #

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