LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations

Podobne knjige/članki

• On the development of protein pKa calculation algorithms
  od: Carstensen, Tommy, et al.
  Izdano: (2011)
• Calculating pKa values in enzyme active sites
  od: Nielsen, Jens Erik, et al.
  Izdano: (2003)
• On the evaluation and optimization of protein X-ray structures for pKa calculations
  od: Nielsen, Jens Erik, et al.
  Izdano: (2003)
• Explicit solvent models in protein pKa calculations.
  od: Gibas, C J, et al.
  Izdano: (1996)
• pKa calculations for class A beta-lactamases: methodological and mechanistic implications.
  od: Raquet, X, et al.
  Izdano: (1997)