dsvatunek Goto Github PK
Name: Dennis Svatunek
Type: User
Bio: Computational Chemist @ UCLA @Click_Chemist
Blog: https://dsvatunek.com
Name: Dennis Svatunek
Type: User
Bio: Computational Chemist @ UCLA @Click_Chemist
Blog: https://dsvatunek.com
Supporting files for "Unraveling the Bürgi-Dunitz Angle with Precision: The Power of a Two-Dimensional Energy Decomposition Analysis"
WebGL accelerated JavaScript molecular graphics library
Automated reaction discovery and dataset generation with the growing string method
autoDIAS: a python tool for an automated Distortion/Interaction Activation Strain Analysis
Animation engine for explanatory chemistry videos
RDKit implementation of ConfBuster - a macrocycle conformer generator. Available on conda.
Changes the phases in a Gaussian cube file
Supporting Information
Converts CYLview POV-Ray files to LookingGlass Portrait quilts
Quick and dirty script to grab dihedral angle from multi-xyz files.
Google Research
codes for the atomic decomposition of the London dispersion energy
Animation engine for explanatory math videos
A tool to select a subset of most representative conformers from a large conformational ensemble.
Code release for NeRF (Neural Radiance Fields)
Images2Mesh Web funded by Netidee
Tunneling Correction to Chemical Kinetics
Sorts atoms in XYZ coordinate files according to position in x-direction
Strain Visualization for Inherently Strained Organic Molecules
Dihedral scanner with wavefront propagation
Converts an xyz file to an RDKit mol object
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.