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- Krawczuk, Anna, et al. Show all 8 Authors
- RSC advances 2018 v.8 no.33 pp. 18672-18681
- antagonists; computational methodology; drugs; geometry; hydrogen bonding; moieties; pharmacology; quantum mechanics
- ... The development of compounds with enhanced activity and selectivity by a conserved spatial orientation of the pharmacophore elements has a long history in medicinal chemistry. Rigidified compounds are an example of this concept. However, the intramolecular interactions were seldom used as a basis for conformational restraints. Here, we show the weak intramolecular interactions that contribute to t ...