Geoffrey R. Hutchison
Computational Theory and Mathematics · 2003–2013
A researcher in the Science corpus: 9 papers; trusts 4 researchers and is trusted by 28 researchers here, as inferred from the citation graph.
Subfields
- Computational Theory and Mathematics — 23 citations into it; #2,771 of 12,182 by trust here, #386 by citations
- Computational Chemistry & Drug Discovery — 19 citations into it; #299 of 425 by trust here, #79 by citations
- Molecular Biology — 18 citations into it; #2,935 of 17,773 by trust here, #7,747 by citations
- Spectroscopy — 12 citations into it; #1,098 of 1,674 by trust here, #123 by citations
Whom Geoffrey R. Hutchison trusts overall
Their strongest outbound trust, strongest first, inferred from their citations.
Who trusts Geoffrey R. Hutchison overall
- Dongsheng Cao
- Patrick Rinke
- Hirotomo Moriwaki
- Tyler W. H. Backman
- Adrià Cereto-Massagué
- Garrett B. Goh
- Abdallah Qteish
- Egon Willighagen
- Qingsong Xu
- Grgoire Montavon
Papers from Geoffrey R. Hutchison's perspective
Ordered by how strongly the researchers Geoffrey R. Hutchison trusts endorse each paper. Same corpus, a different order for every researcher.
- The Blue Obelisk—Interoperability in Chemical Informatics
- Fast calculation of molecular polar surface area as a sum of fragment-based contributions and its application to the prediction of drug transport properties.
- Molecular Similarity Searching Using Atom Environments, Information-Based Feature Selection, and a Naïve Bayesian Classifier
- The Generation of a Unique Machine Description for Chemical Structures-A Technique Developed at Chemical Abstracts Service.
- Automatic atom type and bond type perception in molecular mechanical calculations. (Journal of Molecular Graphics and Modelling)
- SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules
- Development and testing of a general amber force field
- ZINC - A Free Database of Commercially Available Compounds for Virtual Screening
- UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
- Prediction of Physicochemical Parameters by Atomic Contributions
Their papers
- Open Babel: An open chemical toolbox (2011) — 10,088 citations
- The Blue Obelisk—Interoperability in Chemical Informatics (2006) — 381 citations
- Efficient Computational Screening of Organic Polymer Photovoltaics. (2013) — 183 citations
- Computational Design and Selection of Optimal Organic Photovoltaic Materials (2011) — 161 citations
- Cinfony – combining Open Source cheminformatics toolkits behind a common interface (2008) — 48 citations
- Pybel: a Python wrapper for the OpenBabel cheminformatics toolkit (2008) — 373 citations
- Avogadro: an advanced semantic chemical editor, visualization, and analysis platform (2012) — 9,418 citations
- Hopping transport in conductive heterocyclic oligomers: reorganization energies and substituent effects. (2005) — 651 citations
- Charge hopping in molecular wires as a sequence of electron-transfer reactions (2003) — 184 citations