Adrià Cereto-Massagué
Computational Theory and Mathematics · 2015
A researcher in the Science corpus: 1 paper; trusts 3 researchers and is trusted by 0 researchers here, as inferred from the citation graph.
Subfields
- Computational Theory and Mathematics — 22 citations into it
- Molecular Biology — 15 citations into it
- Materials Chemistry — 5 citations into it
Whom Adrià Cereto-Massagué trusts overall
Their strongest outbound trust, strongest first, inferred from their citations.
- Noel M. O'Boyle
- Hongmao Sun
- John J. Irwin
- Andreas Bender
- Christoph Steinbeck
- Georg Hinselmann
- Geoffrey R. Hutchison
- Georgia B. McGaughey
- Antony J. Williams
Who trusts Adrià Cereto-Massagué overall
Papers from Adrià Cereto-Massagué's perspective
Ordered by how strongly the researchers Adrià Cereto-Massagué trusts endorse each paper. Same corpus, a different order for every researcher.
- Recent developments of the chemistry development kit (CDK) - an open-source java library for chemo- and bioinformatics.
- Extended-Connectivity Fingerprints
- The Generation of a Unique Machine Description for Chemical Structures-A Technique Developed at Chemical Abstracts Service.
- Molecular Similarity Searching Using Atom Environments, Information-Based Feature Selection, and a Naïve Bayesian Classifier
- Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance (Journal of Chemical Information and Modeling)
- SMILES. 2. Algorithm for generation of unique SMILES notation
- Open Babel: An open chemical toolbox
- Comparison of Topological, Shape, and Docking Methods in Virtual Screening (Journal of Chemical Information and Modeling)
- ZINC: A Free Tool to Discover Chemistry for Biology
- jCompoundMapper: An open source Java library and command-line tool for chemical fingerprints
Their papers
- Molecular fingerprint similarity search in virtual screening. (2015) — 770 citations