Method for the computational comparison of crystal structures

EL Willighagen, R Wehrens, P Verwer, R de Gelder, LMC Buydens*

*Corresponding author for this work

Research output: Contribution to journalArticleAcademicpeer-review

Original languageEnglish
Pages (from-to)29-36
Number of pages8
JournalActa Crystallographica Section B: Structural Science, Crystal Engineering and Materials
Volume61
DOIs
Publication statusPublished - Feb 2005
Externally publishedYes

Keywords

  • SMALL ORGANIC-MOLECULES
  • STRUCTURE PREDICTION
  • SIMILARITY
  • CLASSIFICATION
  • SPECTRA

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