John C. Shelley

Materials Chemistry · 2001–2010

A researcher in the Science corpus: 6 papers; trusts 5 researchers and is trusted by 0 researchers here, as inferred from the citation graph.

Subfields

Whom John C. Shelley trusts overall

Their strongest outbound trust, strongest first, inferred from their citations.

  1. Yan Zhao
  2. James J. P. Stewart

Who trusts John C. Shelley overall

  1. Wataru Shinoda
  2. Jeremy R. Greenwood
  3. R. Devane
  4. W. Noid

Papers from John C. Shelley's perspective

Ordered by how strongly the researchers John C. Shelley trusts endorse each paper. Same corpus, a different order for every researcher.

  1. Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy.
  2. Exploring the Limit of Accuracy of the Global Hybrid Meta Density Functional for Main-Group Thermochemistry, Kinetics, and Noncovalent Interactions. (Journal of Chemical Theory and Computation)
  3. A fast method of molecular shape comparison: A simple application of a Gaussian description of molecular shape
  4. Glide: a new approach for rapid, accurate docking and scoring. 2. Enrichment factors in database screening.
  5. A shape-based 3-D scaffold hopping method and its application to a bacterial protein-protein interaction.
  6. PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results
  7. Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
  8. An Algorithm for Finding the Smallest Set of Smallest Rings
  9. Integrated Modeling Program, Applied Chemical Theory (IMPACT) (Journal of Computational Chemistry)
  10. Optimization of parameters for semiempirical methods V: Modification of NDDO approximations and application to 70 elements (Journal of Molecular Modeling)

Their papers