sequence, structure, and pathway) information. chemical, pharmacological and pharmaceutical) data with comprehensive drug target (i.e. Bioinformatics and cheminformatics resource combining detailed drug (i.e. Provided by the Department of Pharmaceutical Sciences of the University of Modena and Reggio Emilia. It has single and multi conformer databases prepared for HTVS in different formats like Phase, Catalyst, Unity and SDF. Free suite of multiconformational molecular databases for High-Throughput Virtual Screening. Includes the conversion of chemical names to chemical structures, the generation of SMILES and InChI strings as well as the prediction of many physicochemical parameters. Collection of chemical compunds maintained by the Royal Society of Chemistry. Includes interactions and functional effects of small molecules binding to their macromolecular targets, and series of drug discovery databases. A new version of ZINC database including 100+ million purchasable compounds in ready-to-dock, 3D formats, provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF). Curated collection of commercially available chemical compounds, with 3D coordinates, provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF).
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