Modeling Catalysis in Allosteric Enzymes: Capturing Conformational Consequences.
Allostery
Biocatalysis
Computational chemistry
Conformational ensembles
Molecular Dynamics
Molecular modeling
Reaction mechanisms
Journal
Topics in catalysis
ISSN: 1022-5528
Titre abrégé: Top Catal
Pays: United States
ID NLM: 101696165
Informations de publication
Date de publication:
Feb 2022
Feb 2022
Historique:
entrez:
28
10
2022
pubmed:
29
10
2022
medline:
29
10
2022
Statut:
ppublish
Résumé
Greater understanding of enzymatic mechanisms aids the discovery of new targets for biologics, the development of biocatalytic transformations, and
Identifiants
pubmed: 36304771
doi: 10.1007/s11244-021-01521-1
pmc: PMC9603403
mid: NIHMS1810107
doi:
Types de publication
Journal Article
Langues
eng
Pagination
165-186Subventions
Organisme : NIAID NIH HHS
ID : R01 AI166050
Pays : United States
Déclaration de conflit d'intérêts
Conflict of interest The authors do not have conflicts of interest to declare.
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