Mahendra Awale
University of Bern(CH)
Publications by Year
Research Areas
Computational Drug Discovery Methods, Analytical Chemistry and Chromatography, Microbial Natural Products and Biosynthesis, Synthesis and biological activity, Chemical Synthesis and Analysis
Most-Cited Works
- → Exploring Chemical Space for Drug Discovery Using the Chemical Universe Database(2012)319 cited
- → Polypharmacology Browser PPB2: Target Prediction Combining Nearest Neighbors with Machine Learning(2018)170 cited
- → The polypharmacology browser: a web-based multi-fingerprint target prediction tool using ChEMBL bioactivity data(2017)123 cited
- → Atom Pair 2D-Fingerprints Perceive 3D-Molecular Shape and Pharmacophores for Very Fast Virtual Screening of ZINC and GDB-17(2014)95 cited
- → Mapping the Azolog Space Enables the Optical Control of New Biological Targets(2019)89 cited
- → Stereoselective virtual screening of the ZINC database using atom pair 3D-fingerprints(2015)77 cited
- → MQN-Mapplet: Visualization of Chemical Space with Interactive Maps of DrugBank, ChEMBL, PubChem, GDB-11, and GDB-13(2013)76 cited
- → Fragment Database FDB-17(2017)73 cited
- → SMIfp (SMILES fingerprint) Chemical Space for Virtual Screening and Visualization of Large Databases of Organic Molecules(2013)69 cited
- → Discovery of a Selective Aurora A Kinase Inhibitor by Virtual Screening(2016)67 cited