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Name: Nico Gastellu
Type: User
Name: Nico Gastellu
Type: User
Efficient Protein Mutagenisis using Bayesian Optimization
manuscript
A set of Julia modules to diagonalise TB Hamiltonians for very large MAC fragments.
Analysis scripts of results from `ArpackMAC` calculations
Quantum chemistry and solid state physics software package
Python framework capable of prediciting the electron powder diffraction pattern of any crystal structure. This software can take into account the asymmetries in electron density for the atoms in the specified unit cell.
Series of scripts for quantifying the type and degree of disorder in amorphous monolayer carbon
A toolkit for developing and comparing reinforcement learning algorithms.
Some Julia code to simulate charge hopping using the master equation approach (transplanted from my `percolate_mac` repo).
Scripts and modules to study hyperuniformity (mainly through density fluctuations)
Suite of scripts to track how certain molecular orbital attributes evolve during a molecular dynamics simulation of MAC.
Python scripts modelling conductance through MAC using Landauer-Buttiker
Code whose aime is to derive MAC's electronic transport properties using percolation theory
Python module for quantum chemistry
Set of functions to process quantum chemical dta and to read from QCFFPI output files.
Parameter scan of the toy model describing a vibrating molecular junction described in https://doi.org/10.1039/C2CP40851A
Python tools to produce pole figures and predict the electron diffraction of textured polycrystalline samples
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.