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PQR is an online database of molecular properties predicted from quantum mechanics with integrated capabilities for molecular visualization and data sharing. ased on the number of molecules, PQR is currently the largest open database of molecular quantum calculations. PQR features interactive high-quality rendering of molecular structures and properties on computers, tablets, and cell phones and allows to efficiently share data via digital object identifiers (DOI) and scannable QR barcodes.
Country
The Centre conducts real-time data collection on all ongoing and incoming General and Assembly Elections, and diffuses data-driven analysis through print and electronic media. The coverage includes the analysis, contextualization, and visualisation of results and the profiling of main parties candidates. For each election, we assemble a team of field researchers and scholars to complete and expand existing data. Besides the ECI results data, we collect information on the socio-demographic profile of main parties’ candidates and on the sociological profile of constituencies.
The CCKP contains environmental, disaster risk, and socio-economic datasets, as well as synthesis products, such as the Climate Adaptation Country Profiles, which are built and packaged for specific user-focused functions such as climate change indices for a particular country. The portal also provides intelligent links to other resources and tools.
PSnpBind is a large database of protein–ligand complexes covering a wide range of binding pocket mutations and small molecules’ landscape. This database can be used as a source of data for different types of studies, for example, developing machine learning algorithms to predict protein–ligand affinity or mutation's effect on it which requires an extensive amount of data with a wide coverage of mutation types and small molecules. Also, studies of protein-ligand interactions and conformer orientation changes across different mutated versions of a protein can be established using data from PSnpBind.