Better Informed Distance Geometry: Using What We Know To Improve Conformation Generation

2015 ◽  
Vol 55 (12) ◽  
pp. 2562-2574 ◽  
Author(s):  
Sereina Riniker ◽  
Gregory A. Landrum
Keyword(s):  
Distance Geometry ◽  
Conformation Generation

scholarly journals A New Algorithm for the $$^K$$DMDGP Subclass of Distance Geometry Problems with Exact Distances

Algorithmica ◽  
2021 ◽  
Author(s):  
Douglas S. Gonçalves ◽  
Carlile Lavor ◽  
Leo Liberti ◽  
Michael Souza
Keyword(s):  
Distance Geometry ◽  
Distance Geometry Problems

scholarly journals Unassigned distance geometry and molecular conformation problems

2021 ◽  
Author(s):  
Phil Duxbury ◽  
Carlile Lavor ◽  
Leo Liberti ◽  
Luiz Leduino de Salles-Neto
Keyword(s):  
Molecular Conformation ◽  
Distance Geometry

scholarly journals Maximum feasible subsystems of distance geometry constraints

2021 ◽  
Author(s):  
Maurizio Bruglieri ◽  
Roberto Cordone ◽  
Leo Liberti
Keyword(s):  
Distance Geometry
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