Life-science applications of the Cambridge Structural Database.

  title={Life-science applications of the Cambridge Structural Database.},
  author={Robin James Taylor},
  journal={Acta crystallographica. Section D, Biological crystallography},
  volume={58 Pt 6  No 1},
Several studies show that the molecular geometries and intermolecular interactions observed in small-molecule crystal structures are relevant to the modelling of in vivo situations, although the influence of crystal packing is sometimes important and should always be borne in mind. Torsional distributions derived from the Cambridge Structural Database (CSD) can be used to map out potential-energy surfaces and thereby help identify experimentally validated conformational minima of molecules with… CONTINUE READING

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