ChemHTPS is an automated high-throughput screening platform for generating materials and chemical data
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Updated
Aug 2, 2020 - Python
ChemHTPS is an automated high-throughput screening platform for generating materials and chemical data
A Python package for extracting and simulating diffuse scattering of X-rays in protein crystals
A lightweight and easy to customize python package to perform pre- and post-processing of molecular modelling
⚡ A repository containing research outputs from my computational chemistry Honours project.
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