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Found 11 result(s)

Chempound

a Web2.0-inspired repository for physical science data

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Chempound is a new generation repository architecture based on RDF, semantic dictionaries and linked data. It has been developed to hold any type of chemical object expressible in CML and is exemplified by crystallographic experiments and computational chemistry calculations. In both examples, the repository can hold >50k entries which can be searched by SPARQL endpoints and pre-indexing of key fields. The Chempound architecture is general and adaptable to other fields of data-rich science. The Chempound software is hosted at http://bitbucket.org/chempound and is available under the Apache License, Version 2.0

NAWI Water DAMS

National Alliance for Water Innovation Water Data Analysis and Management System

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Water DAMS (Water Data Analysis and Management System) provides access to foundational water treatment technology data that enable researchers and decision-makers to identify and quantify opportunities for technology innovations to reduce the cost and energy intensity of desalination. It is the submission point for all data generated by research conducted by the National Alliance for Water Innovation (NAWI) and is designed to be used by the broader water research community. With publicly accessible contributions from a variety of academic and industrial partners, Water DAMS seeks to enable data discoverability, improve accessibility, and accelerate collaboration that contributes to pipe parity and innovation in water treatment technologies.

OEDI

Open Energy Data Initiative

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OEDI is a centralized repository of high-value energy research datasets aggregated from the U.S. Department of Energy’s Programs, Offices, and National Laboratories. Built to enable data discoverability, OEDI facilitates access to a broad network of findings, including the data available in technology-specific catalogs like the Geothermal Data Repository and Marine Hydrokinetic Data Repository.

Open Core Data

OCD

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Open Core Data is a data infrastructure focused on making data from scientific continental and ocean drilling projects semantically discoverable, persistent, citable, and approachable to maximize their utility to present and future geoscience researchers.

European Data Portal

EDP

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The European Data Portal harvests the metadata of Public Sector Information available on public data portals across European countries. Information regarding the provision of data and the benefits of re-using data is also included.

GlyTouCan

International Glycan Repository

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GlyTouCan is the international glycan structure repository. This repository is a freely available, uncurated registry for glycan structures that assigns globally unique accession numbers to any glycan independent of the level of information provided by the experimental method used to identify the structure(s). Any glycan structure, ranging in resolution from monosaccharide composition to fully defined structures can be registered as long as there are no inconsistencies in the structure.

Rhea

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Rhea is a freely available and comprehensive resource of expert-curated biochemical reactions. It has been designed to provide a non-redundant set of chemical transformations for applications such as the functional annotation of enzymes, pathway inference and metabolic network reconstruction. There are three types of reaction participants (reactants and products): Small molecules, Rhea polymers, Generic compounds. All three types of reaction participants are linked to the ChEBI database (Chemical Entities of Biological Interest) which provides detailed information about structure, formula and charge. Rhea provides built-in validations that ensure both mass and charge balance of the reactions. We have populated the database with the reactions found in the enzyme classification (i.e. in the IntEnz and ENZYME databases), extending it with additional known reactions of biological interest. While the main focus of Rhea is enzyme-catalysed reactions, other biochemical reactions (including those that are often termed "spontaneous") also are included.

MPDS

Materials Platform for Data Science

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Online materials database (known as PAULING FILE project) with nearly 2 million entries: physical properties, crystal structures, phase diagrams, available via API, ready for modern data-intensive applications. The source of these entries are about 0.5M peer-reviewed publications in materials science, processed during the last 30 years by an international team of PhD editors. The results are presented online with a quick search interface. The basic access is provided for free.

MHKDR

Marine and Hydrokinetic Data Repository

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The MHKDR is the repository for all data collected using funds from the Water Power Technologies Office (WPTO) of the U.S. Department of Energy (DOE). It was established to receive, manage, and make available all water power relevant data generated from projects funded by the DOE Water Power Technologies Office. This includes data from WPTO-funded projects associated with any portion of the water power project life-cycle (exploration, development, operation), as well as data produced by WPTO-funded research.

ChEMBL

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ChEMBL is a database of bioactive drug-like small molecules, it contains 2-D structures, calculated properties (e.g. logP, Molecular Weight, Lipinski Parameters, etc.) and abstracted bioactivities (e.g. binding constants, pharmacology and ADMET data). The data is abstracted and curated from the primary scientific literature, and cover a significant fraction of the SAR and discovery of modern drugs We attempt to normalise the bioactivities into a uniform set of end-points and units where possible, and also to tag the links between a molecular target and a published assay with a set of varying confidence levels. Additional data on clinical progress of compounds is being integrated into ChEMBL at the current time.

Geothermal Data Repository

GDR

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The GDR is the submission point for all data collected from researchers funded by the U.S. Department of Energy's Geothermal Technologies Office. It was established to receive, manage, and make available all geothermal-relevant data generated from projects funded by the DOE Geothermal Technologies Office. This includes data from GTO-funded projects associated with any portion of the geothermal project life-cycle (exploration, development, operation), as well as data produced by GTO-funded research.