Reaction centre accessibility. II. Role of reaction centre congestion in the calculation of reaction centre accessibility

DOI10.1016/S0097-8485(00)00069-3MaRDI QIDQ4458857zbMATH OpenWikidataFDO

Authors Sergio Magni, Guido Sello

Publication date 14 March 2004

Published in Computers & Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/S0097-8485(00)00069-3

zbMATH Keywords

Centre accessibilityCongestionFlexibilityModellingReactivity

Mathematics Subject Classification ID

Classical flows, reactions, etc. in chemistry (92E20)

Recommendations

• Reaction centre accessibility. I. Calculation of reaction centre congestion and influence of structure flexibility
• scientific article; zbMATH DE number 1756098
• On state accessibility in reaction systems
• scientific article; zbMATH DE number 2088279
• Estimation of reactive fluxes in gradient stochastic systems using an analogy with electric circuits

Cited in

(1)

• Reaction centre accessibility. I. Calculation of reaction centre congestion and influence of structure flexibility

This page was built for publication: Reaction centre accessibility. II. Role of reaction centre congestion in the calculation of reaction centre accessibility

Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q4458857)