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David W. Kastner's Projects

3dscience icon 3dscience

MIT 20.S947 course on 3D scientific rendering

eden icon eden

Data-centric model for identifying the ideal U.S. city.

moleculearn icon moleculearn

Extract patterns from ab-initio molecular dynamics simulations using machine learning.

pyef icon pyef

Package for the calculating electric fields and ESP in molecular systems.

pyqmmm icon pyqmmm

Python package for working with multiscale simulation data.

quantumallostery icon quantumallostery

Identify electronic allostery in ab-initio molecular dynamics simulations.

quantumpdb icon quantumpdb

Workflow for generate a database of proteins with quantum properties

sandworm icon sandworm

Weekend hobby project to build simple playable simulations

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