Pavel G. Polishchuk
Computational Theory and Mathematics · 2009–2017
A researcher in the Science corpus: 5 papers; trusts 3 researchers and is trusted by 0 researchers here, as inferred from the citation graph.
Subfields
- Computational Theory and Mathematics — 20 citations into it
- Molecular Biology — 15 citations into it
- Computational Chemistry & Drug Discovery — 11 citations into it
Whom Pavel G. Polishchuk trusts overall
Their strongest outbound trust, strongest first, inferred from their citations.
- Roberto Todeschini
- Lars Ruddigkeit
- John J. Irwin
- David Meyer
- Viviana Consonni
- Ruud Van Deursen
- Jean-Louis Reymond
- Teague Sterling
Who trusts Pavel G. Polishchuk overall
Papers from Pavel G. Polishchuk's perspective
Ordered by how strongly the researchers Pavel G. Polishchuk trusts endorse each paper. Same corpus, a different order for every researcher.
- Enumeration of 166 Billion Organic Small Molecules in the Chemical Universe Database GDB-17
- Misc Functions of the Department of Statistics (e1071), TU Wien
- Handbook of Molecular Descriptors
- ZINC: A Free Tool to Discover Chemistry for Biology
- Virtual screening : an overview
- Virtual exploration of the small-molecule chemical universe below 160 Daltons.
- Virtual Computational Chemistry Laboratory – Design and Description
- Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings.
- A Medicinal Chemist’s Guide to Molecular Interactions
- Benchmarking sets for molecular docking.
Their papers
- Structure–reactivity modeling using mixture-based representation of chemical reactions (2017) — 25 citations
- Estimation of the size of drug-like chemical space based on GDB-17 data (2013) — 586 citations
- Universal Approach for Structural Interpretation of QSAR/QSPR Models (2013) — 64 citations
- Interpretation of QSAR Models Based on Random Forest Methods (2011) — 77 citations
- Application of Random Forest Approach to QSAR Prediction of Aquatic Toxicity (2009) — 154 citations