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Schrödinger, Inc.

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  • Explore PyMOL Open Source

    Open-source foundation of the PyMOL molecular visualization system, maintained by Schrödinger. While PyMOL is a commercial product, we make most of its source code freely available.

  • Explore Maestro Parser

    Reader/writer for Schrödinger Maestro files.

  • Explore GPUSimilarity

    The commercial GPUSimilarity product, which is an RDKit-based GPU implementation of chemical fingerprint similarity searching.

Visit schrodinger.com to learn more.

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  1. pymol-open-source pymol-open-source Public

    Open-source foundation of the user-sponsored PyMOL molecular visualization system.

    C 1.6k 335

  2. gpusimilarity gpusimilarity Public

    A Cuda/Thrust implementation of fingerprint similarity searching

    C++ 110 24

  3. maeparser maeparser Public

    maestro file parser

    C++ 28 27

  4. fixed-data-table-2 fixed-data-table-2 Public

    A React table component designed to allow presenting millions of rows of data.

    JavaScript 1.3k 288

Repositories

Showing 10 of 112 repositories
  • sketcher Public

    Schrödinger 2D Sketcher

    schrodinger/sketcher’s past year of commit activity
    C++ 22 BSD-3-Clause 9 0 10 Updated Jan 26, 2026
  • fep-restraints Public

    Tools to add restraints to FEP runs. Includes a workflow to determine reference structures and restraint widths from plain MD simulations.

    schrodinger/fep-restraints’s past year of commit activity
    Python 11 5 0 0 Updated Jan 24, 2026
  • fixed-data-table-2 Public

    A React table component designed to allow presenting millions of rows of data.

    schrodinger/fixed-data-table-2’s past year of commit activity
    JavaScript 1,307 288 41 (20 issues need help) 4 Updated Jan 21, 2026
  • coordgenlibs Public

    Schrodinger-developed 2D Coordinate Generation

    schrodinger/coordgenlibs’s past year of commit activity
    C++ 46 BSD-3-Clause 32 23 1 Updated Jan 15, 2026
  • maeparser Public

    maestro file parser

    schrodinger/maeparser’s past year of commit activity
    C++ 28 MIT 27 2 1 Updated Jan 13, 2026
  • stack-the-future-demo Public
    schrodinger/stack-the-future-demo’s past year of commit activity
    HTML 0 1 0 0 Updated Jan 12, 2026
  • linux_package_requirement Public

    Script to check required packages for Schrödinger suite on Linux machine

    schrodinger/linux_package_requirement’s past year of commit activity
    Shell 13 2 0 0 Updated Jan 7, 2026
  • pymol-open-source Public

    Open-source foundation of the user-sponsored PyMOL molecular visualization system.

    schrodinger/pymol-open-source’s past year of commit activity
    C 1,567 335 90 (2 issues need help) 8 Updated Dec 24, 2025
  • q-e Public
    schrodinger/q-e’s past year of commit activity
    Fortran 3 GPL-2.0 0 0 0 Updated Dec 22, 2025
  • stack-the-future-template Public template
    schrodinger/stack-the-future-template’s past year of commit activity
    HTML 1 2 0 0 Updated Dec 11, 2025
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