Stefan Kuhn

Computational Chemistry & Drug Discovery · 2003–2017

A researcher in the Science corpus: 3 papers; trusts 1 researcher and is trusted by 6 researchers here, as inferred from the citation graph.

Subfields

Whom Stefan Kuhn trusts overall

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

  1. David Weininger

Who trusts Stefan Kuhn overall

  1. Michael Kuhn
  2. Noel M. O'Boyle
  3. Marwin H. S. Segler

Papers from Stefan Kuhn's perspective

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

  1. Recent developments of the chemistry development kit (CDK) - an open-source java library for chemo- and bioinformatics.
  2. Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry (BMC Bioinformatics)
  3. Knapsack Problems: Algorithms and Computer Implementations
  4. Searching molecular structure databases with tandem mass spectra using CSI:FingerID (Proceedings of the National Academy of Sciences of the United States of America)
  5. SIRIUS: decomposing isotope patterns for metabolite identification (Bioinform.)
  6. The ChEMBL bioactivity database: an update
  7. Sharing and community curation of mass spectrometry data with GNPS (Nature Biotechnology)
  8. SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules
  9. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands (Nucleic Acids Res.)
  10. SMILES. 2. Algorithm for generation of unique SMILES notation

Their papers