A halogen-bonding correction for the semiempirical PM6 method
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference22 articles.
1. Halogen Bonding,2008
2. Halogen bonds in biological molecules
3. Halogen bonding: an electrostatically-driven highly directional noncovalent interaction
4. An overview of halogen bonding
5. Halogen Bonding: A Paradigm in Supramolecular Chemistry
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