Pinned Repositories
RecipeApp
ligand_interaction
remove_far_waters
track_s1_water
anagram_maker
Find anagrams of a query search word.
mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
mdtraj
An open library for the analysis of molecular dynamics trajectories
mdtraj_tools
ML_projects
A collection of Machine Learning / Data Science projects I have done
molssi_course_molecool
Functions for molecular visualization. Part of the MolSSI best practices course.
leonwehrhan's Repositories
leonwehrhan/ML_projects
A collection of Machine Learning / Data Science projects I have done
leonwehrhan/mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
leonwehrhan/RecipeApp
leonwehrhan/Trypsin_BPTI_Prebound_RAMD_2024
leonwehrhan/ligand_interaction
leonwehrhan/anagram_maker
Find anagrams of a query search word.
leonwehrhan/track_s1_water
leonwehrhan/RAMD
leonwehrhan/remove_far_waters
leonwehrhan/rotate_to_axis
leonwehrhan/mdtraj_tools
leonwehrhan/quadprog
Quadratic Programming Solver
leonwehrhan/molssi_course_molecool
Functions for molecular visualization. Part of the MolSSI best practices course.
leonwehrhan/periodic-table
leonwehrhan/mdtraj
An open library for the analysis of molecular dynamics trajectories