A Crystal web framework that makes building applications fast, simple, and enjoyable. Get started with quick prototyping, less bugs, and blazing fast performance.
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Updated
Dec 13, 2024 - Crystal
A Crystal web framework that makes building applications fast, simple, and enjoyable. Get started with quick prototyping, less bugs, and blazing fast performance.
The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
List of molecules (small molecules, RNA, peptide, protein, enzymes, antibody, and PPIs) conformations and molecular dynamics (force fields) using generative artificial intelligence and deep learning
A project (and object) for storing, manipulating, and converting molecular mechanics data.
Introduction to the Amber web framework and its features
A command line application to launch molecular dynamics simulations with OpenMM
A Package for Parametrization of Molecular Mechanics Force Fields
Web Components implementation of the Amber Design System.
Build atomistic structures of carbon nanotubes with the possibility to add functional groups (OH, COOH, COO-) and assigns generalized Amber (GAFF) parameters to them.
openHAB binding to receive and decode WMBus messages (OMS+Techem)
Longbow is a tool for automating simulations on a remote HPC machine. Longbow is designed to mimic the normal way an application is run locally but allows simulations to be sent to powerful machines.
PaCS-Toolkit: Optimized software utilities for PaCS-MD and following analysis
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