Molecular dynamics and free energy analysis of neuraminidase–ligand interactions

Eitemau Tebyg

• Statistical Estimation of the Protein-Ligand Binding Free Energy Based On Direct Protein-Ligand Interaction Obtained by Molecular Dynamics Simulation
  gan: Fukunishi, Yoshifumi, et al.
  Cyhoeddwyd: (2012)
• Free Energy Calculations using a Swarm-Enhanced Sampling Molecular Dynamics Approach
  gan: Burusco, Kepa K, et al.
  Cyhoeddwyd: (2015)
• Carbohydrate-protein recognition: molecular dynamics simulations and free energy analysis of oligosaccharide binding to concanavalin A.
  gan: Bryce, R A, et al.
  Cyhoeddwyd: (2001)
• Characterizing Loop Dynamics and Ligand Recognition in Human- and Avian-Type Influenza Neuraminidases via Generalized Born Molecular Dynamics and End-Point Free Energy Calculations
  gan: Amaro, Rommie E., et al.
  Cyhoeddwyd: (2009)
• Molecular Recognition in a Diverse Set of Protein-Ligand Interactions Studied with Molecular Dynamics Simulations and End-Point Free Energy Calculations
  gan: Wang, Bo, et al.
  Cyhoeddwyd: (2013)