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Type: User
Twitter: Clark45657011
Location: Bayamón, Puerto Rico
Type: User
Twitter: Clark45657011
Location: Bayamón, Puerto Rico
Quantum chemistry program executor and IO standardizer (QCSchema).
A distributed compute and database platform for quantum chemistry.
QM/MM hydration free energy playground
Scripts for assisting in modeling quantitative structure activity relationships from 2D chemical data
quanformer: quantum mechanical analysis of molecular conformers
A script to run structural alerts using the RDKit and ChEMBL
Wrapper for RDKit's RunReactants to improve stereochemistry handling
A collection of cheminformatics scripts that use rdkit
Molecular De Novo design using Recurrent Neural Networks and Reinforcement Learning
Deep Reinforcement Learning for de-novo Drug Design
Implementation of open-source version of RESP method
A command-line tool for simple, single-step retrosynthetic reaction prediction using graph partitioning.
Retrosynthesis planner
Python version of the amazing Reaction Mechanism Generator (RMG).
A Django-powered website for Reaction Mechanism Generator (RMG)
🔧rna-tools: a toolbox to analyze sequences, structures and simulations of RNA (and more) docs @ http://rna-tools.rtfd.io
RNArtist allows you to design and paint your RNA 2D structures interactively. Coupled with the 3D viewer UCSF Chimera, use your 2D as a map to explore RNA 3D architectures.
Python wrapper to design RNA molecules using RNAblueprint, RNARedPrint and for energy evaluations ViennaRNA, Hotknots, pKiss and Nupack.
Laboratory automation toolkits
Compute dynamic properties of chemical systems using ring polymer molecular dynamics simulations
Recurrent Units-based Molecular Modeling
Tests against namespace packages
Self-adjusted mixture sampling experiments
Affinity maturation of antibody variable fragments
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.