ArticleChemical science2016
Accessing and predicting the kinetic profiles of homogeneous catalysts from volcano plots.
Article in Chemical science, 2016. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 22 papers.
What it found
Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.
The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
The trial behind it
Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.
Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.
Who cites it
22 citing papers in PubMed.
- Boosting COJournal of computational chemistry · 2026Article
- Breaking the Brønsted-Evans-Polanyi Relation with Dual-Metal Sites.The journal of physical chemistry letters · 2025Article
- SPOCK Tool for Constructing Empirical Volcano Diagrams from Catalytic Data.ACS catalysis · 2025Article
- A multi-modal transformer for predicting global minimum adsorption energy.Nature communications · 2025Article
- Computational tools for the prediction of site- and regioselectivity of organic reactions.Chemical science · 2025Review
- Data-driven discovery of active phosphine ligand space for cross-coupling reactions.Chemical science · 2024Article
- Microkinetic Molecular Volcano Plots for Enhanced Catalyst Selectivity and Activity Predictions.ACS catalysis · 2024Article
- Article
- Automated de Novo Design of Olefin Metathesis Catalysts: Computational and Experimental Analysis of a Simple Thermodynamic Design Criterion.Journal of chemical information and modeling · 2024Article
- Computational design for enantioselective COBeilstein journal of organic chemistry · 2024Article
- Ratcheting synthesis.Nature reviews. Chemistry · 2024Review
- Theory-guided development of homogeneous catalysts for the reduction of COChemical science · 2023Article
- Constructing and interpreting volcano plots and activity maps to navigate homogeneous catalyst landscapes.Nature protocols · 2022Review
- Computational Analysis of Structure - Activity Relationships in Highly Active Homogeneous Ruthenium-based Water Oxidation Catalysts.Catalysts (Basel, Switzerland) · 2022Article
- Mapping Catalyst-Solvent Interplay in Competing Carboamination/Cyclopropanation Reactions.Chemistry (Weinheim an der Bergstrasse, Germany) · 2022Article
- New Strategies for Direct Methane-to-Methanol Conversion from Active Learning Exploration of 16 Million Catalysts.JACS Au · 2022Article
- Uncovering the Activity of Alkaline Earth Metal Hydrogenation Catalysis Through Molecular Volcano Plots.Topics in catalysis · 2022Article
- Data-powered augmented volcano plots for homogeneous catalysis.Chemical science · 2020Article
- One-Pot Cooperation of Single-Atom Rh and Ru Solid Catalysts for a Selective Tandem Olefin Isomerization-Hydrosilylation Process.Angewandte Chemie (International ed. in English) · 2020Article
- Surface chemistry dictates stability and oxidation state of supported single metal catalyst atoms.Chemical science · 2020Article
Corrections and comments
PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.
Authors and funding
3 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
Volcano plots are frequently used as aids in the search for new heterogeneous and electrochemical catalysts. These tools successfully predict catalytic processes based solely on thermodynamic descriptions, which also capably describe many aspects of the catalytic cycles of homogeneous species. However, homogeneous catalysts also frequently depend upon the kinetic influences brought about by steric interactions to promote or prevent specific chemical reactions. Here, a prototypical transformation facilitated by a homogeneous catalysis, the hydroformylation of an olefin using CO and H
Identifiers
What OpenQuestion holds
Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.