Pinned Loading

1. boltz-generalized-covalent-modification boltz-generalized-covalent-modification Public

   Allows using Boltz to predict the structure of arbitrary covalent modifications / Non-Canonical Amino Acids. Covalent bonds are enforced. Also walks you through injecting a new residue into the CCD.

   Jupyter Notebook 4 2

2. calc_symmetry_aware_rmsd.py calc_symmetry_aware_rmsd.py

   1

   import io

   2

   import os

   3

   from pathlib import Path

   4

   from rdkit import Chem

   5

   from rdkit.Chem import AllChem

3. REINFORCEmers REINFORCEmers Public

   Final Project for Harvard CS184: Introduction to Reinforcement Learning

   Python 1

4. Graduate-School-Faculty-Ranker Graduate-School-Faculty-Ranker Public

   Webscraper for sorting potential graduate school program's faculty lists by common interests in the areas of computational protein and drug design

   Jupyter Notebook

5. Machine-Learning-Fundamentals Machine-Learning-Fundamentals Public

   A collection of Machine Learning models implemented from math to model in jupyter notebook.

   Jupyter Notebook 2

6. neovim-config neovim-config Public

   Neovim configuration featuring nerdtree, lightline, nerdcomments, autocompletion and snippets, catppuccin colorscheme, and sensible defaults

   Vim Script 1