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Chemistry

D-Index
60
Citations
12629
World Ranking
9707
National Ranking
552

Research.com Recognitions

  • 2013 - Bader Award, Royal Society of Chemistry (UK)

Overview

Jonathan M. Goodman is affiliated with the University of Cambridge in the United Kingdom. Their primary field of study is Chemistry, supported by a body of 54 publications. The research spans multiple subfields, including Organic Chemistry, Molecular Biology, Computational Theory and Mathematics, Spectroscopy, and Materials Chemistry.

The scientist's work focuses on several main topics related to chemistry and computational methods. These include:

  • Computational Drug Discovery Methods
  • Molecular spectroscopy and chirality
  • Machine Learning in Materials Science
  • Metabolomics and Mass Spectrometry Studies
  • Radical Photochemical Reactions
  • Asymmetric Synthesis and Catalysis
  • Asymmetric Hydrogenation and Catalysis

Jonathan M. Goodman has authored research published in notable venues as follows:

  • Chemical Science (6 publications)
  • Apollo (University of Cambridge) (6 publications)
  • Environmental Health Perspectives (3 publications)
  • Organic & Biomolecular Chemistry (3 publications)
  • Journal of Chemical Information and Modeling (3 publications)

The collaboration network of the scientist includes frequent co-authors such as:

  • Timothy E. H. Allen
  • Kristaps Ermanis
  • Sanha Lee
  • Ching Ching Lam
  • Andrew J. Wedlake

Some recent research papers authored by Jonathan M. Goodman include:

  • "A review of molecular representation in the age of machine learning", 2022, Wiley Interdisciplinary Reviews Computational Molecular Science
  • "DP4-AI automated NMR data analysis: straight from spectrometer to structure", 2020, Chemical Science
  • "CATMoS: Collaborative Acute Toxicity Modeling Suite", 2021, Environmental Health Perspectives
  • "Machine Learning in Predictive Toxicology: Recent Applications and Future Directions for Classification Models", 2020, Chemical Research in Toxicology
  • "A Computational and Experimental Investigation of the Origin of Selectivity in the Chiral Phosphoric Acid Catalyzed Enantioselective Minisci Reaction", 2020, Journal of the American Chemical Society

The researcher was awarded the Bader Award by the Royal Society of Chemistry (UK) in 2013.

Best Publications

  • Assigning Stereochemistry to Single Diastereoisomers by GIAO NMR Calculation: The DP4 Probability

    Steven G. Smith;Jonathan M. Goodman

  • The molecular basis for selective inhibition of unconventional mRNA splicing by an IRE1-binding small molecule

    Benedict C. S. Cross;Peter J. Bond;Pawel G. Sadowski;Babal Kant Jha

  • A review of molecular representation in the age of machine learning

    Unknown

  • Polymorph control: past, present and future.

    Antonio Llinàs;Jonathan M. Goodman

  • Enantio- and diastereoselective aldol reactions of achiral ethyl and methyl ketones with aldehydes: the use of enol diisopinocampheylborinates

    Ian Paterson;Jonathan M. Goodman;M. Anne Lister;Russell C. Schumann

  • Theoretical Study of the Mechanism of Hantzsch Ester Hydrogenation of Imines Catalyzed by Chiral BINOL-Phosphoric Acids

    Luis Simón;Jonathan M. Goodman

  • Assigning the stereochemistry of pairs of diastereoisomers using GIAO NMR shift calculation.

    Steven G. Smith;Jonathan M. Goodman

  • An unbounded systematic search of conformational space

    Jonathan M. Goodman;W. Clark Still

  • How reliable are DFT transition structures? Comparison of GGA, hybrid-meta-GGA and meta-GGA functionals.

    Luis Simón;Jonathan M. Goodman

  • The mechanism of TBD-catalyzed ring-opening polymerization of cyclic esters.

    Luis Simón;Jonathan M Goodman

  • Aldol reactions in polypropionate synthesis: High π-face selectivity of enol borinates from α-chiral methyl and ethyl ketones under substrate control

    Ian Paterson;Jonathan M. Goodman;Masahiko Isaka

  • Hydrogen Bonding and π-Stacking: How Reliable are Force Fields? A Critical Evaluation of Force Field Descriptions of Nonbonded Interactions

    Robert S. Paton;Jonathan M. Goodman

  • Solubility Challenge : Can You Predict Solubilities of 32 Molecules Using a Database of 100 Reliable Measurements?

    Antonio Llinàs;Robert C. Glen;Jonathan M. Goodman

  • A Model for the Enantioselectivity of Imine Reactions Catalyzed by BINOL−Phosphoric Acid Catalysts

    Luis Simón;Jonathan M. Goodman

  • Defining molecular initiating events in the adverse outcome pathway framework for risk assessment.

    Timothy E. H. Allen;Jonathan M. Goodman;Steve Gutsell;Paul J. Russell

  • A Practical Guide for Predicting the Stereochemistry of Bifunctional Phosphoric Acid Catalyzed Reactions of Imines

    Jolene P. Reid;Luis Simón;Jonathan M. Goodman

  • 10-Helical conformations in oxetane β-amino acid hexamers

    Timothy D.W Claridge;Jonathan M Goodman;Andres Moreno;Donald Angus

  • Mechanistic insights into the BINOL-derived phosphoric acid-catalyzed asymmetric allylboration of aldehydes.

    Matthew N. Grayson;Silvina C. Pellegrinet;Jonathan M. Goodman

  • Diclofenac Solubility: Independent Determination of the Intrinsic Solubility of Three Crystal Forms

    Antonio Llinàs;Jonathan C Burley;Karl J Box;Robert C Glen

  • DP4-AI automated NMR data analysis: straight from spectrometer to structure

    Alexander Howarth;Kristaps Ermanis;Jonathan M. Goodman

  • Site-specific examination of secondary structure and orientation determination in membrane proteins: the peptidic (13)C=(18)O group as a novel infrared probe.

    Jaume Torres;Andreas Kukol;Jonathan M. Goodman;Isaiah T. Arkin

  • DFT study on the factors determining the enantioselectivity of Friedel-Crafts reactions of indole with N-acyl and N-tosylimines catalyzed by BINOL-phosphoric acid derivatives.

    Luis Simón;Jonathan M. Goodman

Frequent Co-Authors

Ian Paterson
Ian Paterson University of Cambridge
Cesare Gennari
Cesare Gennari University of Milan
Anna Bernardi
Anna Bernardi University of Milan
Maxim V. Fedorov
Maxim V. Fedorov Skolkovo Institute of Science and Technology
Robert S. Paton
Robert S. Paton Colorado State University
Angiolina Comotti
Angiolina Comotti University of Milano-Bicocca
Dominic S. Wright
Dominic S. Wright University of Cambridge
Paul R. Raithby
Paul R. Raithby University of Bath
Andrew B. Holmes
Andrew B. Holmes University of Melbourne
Ian H. Gilbert
Ian H. Gilbert University of Dundee

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