CAMD | based sequential learning software for materials discovery | Machine Learning library

 by   TRI-AMDD Python Version: 2022.8.24 License: Apache-2.0

kandi X-RAY | CAMD Summary

kandi X-RAY | CAMD Summary

CAMD is a Python library typically used in Artificial Intelligence, Machine Learning, Deep Learning applications. CAMD has no bugs, it has no vulnerabilities, it has build file available, it has a Permissive License and it has low support. You can install using 'pip install CAMD' or download it from GitHub, PyPI.

CAMD provides a flexible software framework for sequential / Bayesian optimization type campaigns for materials discovery. Its key features include:. A more in-depth description of the scientific framework can be found in this recent open-access article, which demonstrates an end-to-end CAMD-based framework for autonomous inorganic materials discovery using cloud-based density functional theory calculations.
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            kandi-support Support

              CAMD has a low active ecosystem.
              It has 48 star(s) with 25 fork(s). There are 7 watchers for this library.
              OutlinedDot
              It had no major release in the last 12 months.
              There are 5 open issues and 7 have been closed. On average issues are closed in 40 days. There are 6 open pull requests and 0 closed requests.
              It has a neutral sentiment in the developer community.
              The latest version of CAMD is 2022.8.24

            kandi-Quality Quality

              CAMD has 0 bugs and 0 code smells.

            kandi-Security Security

              CAMD has no vulnerabilities reported, and its dependent libraries have no vulnerabilities reported.
              CAMD code analysis shows 0 unresolved vulnerabilities.
              There are 0 security hotspots that need review.

            kandi-License License

              CAMD is licensed under the Apache-2.0 License. This license is Permissive.
              Permissive licenses have the least restrictions, and you can use them in most projects.

            kandi-Reuse Reuse

              CAMD releases are available to install and integrate.
              Deployable package is available in PyPI.
              Build file is available. You can build the component from source.
              Installation instructions, examples and code snippets are available.
              It has 4628 lines of code, 260 functions and 47 files.
              It has medium code complexity. Code complexity directly impacts maintainability of the code.

            Top functions reviewed by kandi - BETA

            kandi has reviewed CAMD and discovered the below as its top functions. This is intended to give you an instant insight into CAMD implemented functionality, and help decide if they suit your requirements.
            • Estimate hypotheses from candidate data
            • Fit the committee
            • Predict mean variance of committee models
            • Create a campaign factory from a chemsysysys
            • Load a dataframe into a pandas dataframe
            • Download a file from S3
            • Download a MATRIO data file
            • Calculate the state of each experiment
            • Analyze VASQP jobs
            • Analyze seed data
            • Update the results of the run
            • Estimate the hypothesis for a given candidate
            • Runs anALM analysis
            • Compute the hypothesis for the candidate data
            • Submit a new workflow
            • Create an instance from a reserved name
            • Get the hypotheses for a given candidate
            • Return new version number
            • Start new campaign
            • Calculate phononformation energy from M3Gnet
            • Update agent pool
            • Load seed data
            • Gather seed data from a pickle file
            • The list of hypo structures in the structure
            • Update changes md file
            • Release camd
            Get all kandi verified functions for this library.

            CAMD Key Features

            No Key Features are available at this moment for CAMD.

            CAMD Examples and Code Snippets

            Computational Autonomy for Materials Discovery (CAMD),Installation,Mac OSX
            Pythondot img1Lines of Code : 4dot img1License : Permissive (Apache-2.0)
            copy iconCopy
            brew install gcc
            
            pip install numpy
            pip install -r requirements.txt
            python setup.py develop
              
            Computational Autonomy for Materials Discovery (CAMD),Installation,Linux
            Pythondot img2Lines of Code : 3dot img2License : Permissive (Apache-2.0)
            copy iconCopy
            pip install numpy
            pip install -r requirements.txt
            python setup.py develop
              

            Community Discussions

            QUESTION

            Difference in behavior between between "normal" build and ExternalProject_Add
            Asked 2019-Jun-04 at 10:09

            I am trying to build the ceres-solver on linux using CMake's external project feature.

            I have a specific version of Eigen that I built and the other dependencies are installed through my packet manager (BLAS, LAPACK and Suitesparse).

            If I build Ceres-solver directly from source:

            ...

            ANSWER

            Answered 2019-Jun-04 at 10:09

            It seems my build folder was corrupted. I just deleted the build folder & the install folder. When I re-run the install, everything worked perfectly.

            Source https://stackoverflow.com/questions/56293558

            QUESTION

            C# MySql how to bind stored procedure with dataGridView
            Asked 2017-Oct-24 at 23:58

            I have here stored procedure and I don't know how to bind to the datagridview, need help with this?

            here mysql code stored procedure:

            ...

            ANSWER

            Answered 2017-Oct-24 at 23:35

            QUESTION

            Class becomes null when exception is thrown
            Asked 2017-Mar-03 at 18:26

            I'm building a desktop application in WPF and I'm debugging an error that is triggered in a property changed method in code behind for a UserControl.

            ...

            ANSWER

            Answered 2017-Mar-03 at 18:26

            FrameworkElementAutomationPeer.FromElement returned null, and calling RaiseAutomationEvent on that caused the NullReferenceException.

            Source https://stackoverflow.com/questions/42583329

            Community Discussions, Code Snippets contain sources that include Stack Exchange Network

            Vulnerabilities

            No vulnerabilities reported

            Install CAMD

            CAMD can be installed using pip as pip install camd. If issues are encountered, we recommend following the installation procedures below:. Note that, since qmpy is currently only python 2.7 compatible, CAMD python 3 compatibility depends on a custom fork of qmpy here, which is installed using the setup.py procedure. We recommend using Anaconda python, and creating a fresh conda environment for the install (e. g. conda create -n MY_ENV_NAME).
            Datasets for featurized OQMD entries for after-the-fact testing can be downloaded at data.matr.io/3. These are done automatically in the code and stored in the camd/_cache directory.

            Support

            For any new features, suggestions and bugs create an issue on GitHub. If you have any questions check and ask questions on community page Stack Overflow .
            Find more information at:

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            Install
          • PyPI

            pip install camd

          • CLONE
          • HTTPS

            https://github.com/TRI-AMDD/CAMD.git

          • CLI

            gh repo clone TRI-AMDD/CAMD

          • sshUrl

            git@github.com:TRI-AMDD/CAMD.git

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