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@isi-nlp @cclib @ReScience @LambrechtLab @isi-vista @algorithm-archivists
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Pinned

  1. Forked from LambrechtLab/libresponse

    A library for solving (linear) response equations in quantum chemistry

    C

  2. Molecular frequency-dependent response properties for arbitrary operators

    Python 4 1

  3. Parsers and algorithms for computational chemistry logfiles

    Python 137 91

  4. Combining Psi4 and Numpy for education and development.

    Jupyter Notebook 94 67

  5. Multiple algorithms for calculating the Boys function

    Rust

  6. Ab initio quantum chemistry in Rust from scratch

    Rust 2

2,018 contributions in the last year

Jul Aug Sep Oct Nov Dec Jan Feb Mar Apr May Jun Jul Mon Wed Fri

Contribution activity

July 2019

Created an issue in isi-vista/curated-training-annotator that received 4 comments

Error when attempting to retrieve annotation from admin user

This particular annotation is causing our exporter to hang: $ curl -u eric_berquist:$INCEPTION_PASSWORD 'http://curatedtraining.isi.edu:8080/api/ae…

4 comments
36 contributions in private repositories Jul 1 – Jul 18

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