C. K. Surratt

Computational Chemistry & Drug Discovery · 2013–2015

A researcher in the Science corpus: 2 papers; trusts 16 researchers and is trusted by 0 researchers here, as inferred from the citation graph.

Subfields

Whom C. K. Surratt trusts overall

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

  1. Jürgen Bajorath
  2. Philip J. Hajduk
  3. David Weininger
  4. I. Khanna
  5. K. Nicolaou
  6. John J. Irwin
  7. Gisbert Schneider

Papers from C. K. Surratt's perspective

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

  1. Molecular Complexity and Its Impact on the Probability of Finding Leads for Drug Discovery (Journal of chemical information and computer sciences)
  2. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings.
  3. ZINC - A Free Database of Commercially Available Compounds for Virtual Screening
  4. A computational procedure for determining energetically favorable binding sites on biologically important macromolecules.
  5. SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules
  6. Integration of virtual and high-throughput screening
  7. Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy.
  8. A Medicinal Chemist’s Guide to Molecular Interactions
  9. The role of ligand efficiency metrics in drug discovery
  10. Development and validation of a genetic algorithm for flexible docking.

Their papers