layeqa Goto Github PK
Type: User
Twitter: Clark45657011
Location: Bayamón, Puerto Rico
Type: User
Twitter: Clark45657011
Location: Bayamón, Puerto Rico
An image to ANSI color coded text converter
A tool for retrosynthetic planning
An open tool implementing some recommended practices for analyzing alchemical free energy calculations
a simple graphical user interface for controlling Amber GPU accelerated molecular dynamics (i.e. pmemd.cuda)
Software for biomolecular electrostatics and solvation calculations
APBS in an AWS environment
Web server and RESTful backend services for APBS and PDB2PQR
APBS web interface
Attach-release-pull: A free energy calculation workflow
Templates for use in preparing articles for the Living Journal of Computational Molecular Sciences (LiveCoMS)
Software package for computer aided synthesis planning
Modeling and Bayesian analysis of fluorescence and absorbance assays.
Bayesian statistics-based assay modelling, accelerated by TensorFlow.
Automatic detection of equilibrated regions of molecular simulations
Sandbox for the development of active-learning algorithms for automated drug discovery.
Python library for generating Autoprotocol
AutoTST: A framework to perform automated transition state theory calculations
A collection of useful CloudFormation templates
A template to create a React app and deploy it with the AWS CloudFormation Action for GitHub Actions on the AWS cloud
A pipeline for simulation of RNA folding on dynamic landscapes
Repository to host our developmental bayesian free energy methods
A bayesian retrosynthesis algorithm
Bayesian Learning on Laboratory Investigation
Compare optimized geometries and energies from various force fields with respect to a QM reference.
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
A few scripts for extra analysis of the bilayer simulations.
Applications of nonequilibrium candidate Monte Carlo (NCMC) to ligand binding mode sampling
PyQt5 port of cadnano2
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.