Explore @schrodinger Open Source projects

Schrodinger, Inc. (@schrodinger)

schrodinger

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fixed-data-table-2

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

pymol-open-source

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

gpusimilarity

A Cuda/Thrust implementation of fingerprint similarity searching

coordgenlibs

Schrodinger-developed 2D Coordinate Generation

maeparser

maestro file parser

pmw-patched

Fork of Python megawidgets with essential patches applied

pymol-testing

PyMOL Testing Framework

simplemmtf-python

MMTF I/O Python Library

public_binding_free_energy_benchmark

The public versio

functional-response

Supporting materials for the functional response manuscript: analysis code, machine-readable results, and FEP starting poses.

fep-restraints

Tools to add restraints to FEP runs (currently only AB-FEP). Includes a workflow to determine reference structures and restraint widths from plain MD simulations.

hacking-the-gender-stack-template

Jupyter Notebook

hackathon-project

Jupyter Notebook

open-source-js-template

Template for creating open source JS projects

infra-tester

YAML configuration based infrastructure testing.

sketcher

Schrödinger 2D Sketcher

JSON-Patch

hacking-the-gender-stack-blue

Jupyter Notebook