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Projects in Awesome Lists by JosieHong

A curated list of projects in awesome lists by JosieHong .

https://github.com/josiehong/3dmolms

[Bioinformatics] 3DMolMS: prediction of tandem mass spectra from 3D molecular conformations

mass-spectrometry molecule

Last synced: 09 Oct 2024

https://github.com/josiehong/3dmolcsp

[Analytical Chemistry] Enhanced Structure-Based Prediction of Chiral Stationary Phases for Chromatographic Enantioseparation from 3D Molecular Conformations

analytical-chemistry chromatography molecule

Last synced: 09 Oct 2024