Pinned Repositories
bcl
The Biochemical Library (BCL) integrates traditional small molecule cheminformatics tools with machine learning-based quantitative structure-activity/property relationship (QSAR/QSPR) modeling. The cheminformatics toolkit contains customizable tools for the design, processing, and analysis of small molecules for computer-aided drug discovery.
AutoSolvate
Automated workflow for generating quantum chemistry calculation of explicitly solvated molecules
aiida_docker_compose
Some examples of docker-compose configurations to start automatically AiiDA and all related services.
bcl
The Biochemical Library (BCL) integrates traditional small molecule cheminformatics tools with machine learning-based quantitative structure-activity/property relationship (QSAR/QSPR) modeling. The cheminformatics toolkit contains customizable tools for the design, processing, and analysis of small molecules for computer-aided drug discovery.
cs334-DNAcodon
cs441_body_cam
happy-birthday
Wish your friend/loved-ones happy birthday in a nerdy way.
Poetry-Data-Vis
pygoat
intentionally vuln web Application Security in django
return_notes
YingrongChen's Repositories
YingrongChen/aiida_docker_compose
Some examples of docker-compose configurations to start automatically AiiDA and all related services.
YingrongChen/bcl
The Biochemical Library (BCL) integrates traditional small molecule cheminformatics tools with machine learning-based quantitative structure-activity/property relationship (QSAR/QSPR) modeling. The cheminformatics toolkit contains customizable tools for the design, processing, and analysis of small molecules for computer-aided drug discovery.
YingrongChen/cs334-DNAcodon
YingrongChen/cs441_body_cam
YingrongChen/happy-birthday
Wish your friend/loved-ones happy birthday in a nerdy way.
YingrongChen/Poetry-Data-Vis
YingrongChen/pygoat
intentionally vuln web Application Security in django
YingrongChen/return_notes
YingrongChen/RstudioNotes
YingrongChen/YingrongChen.github.io