Pinned Repositories
AmarelR
Editing R materials for amarel
AMBER-Umbrella_COM_restraint_tutorial
Tutorial to run AMBER umbrella COM restraint code and derive free energy of transfer profile for methanol through DMPC membrane
chemiscope_visualization
clusfps
A Molecular cluster tools built on RDKit
deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
kalshi-trades
Kalshi Python API + trading
matminer-webapp
practical_cheminformatics_tutorials
Practical Cheminformatics Tutorials
quantlearning
Learning quant trading basics using Python
conformer-rl
A deep reinforcement learning library for conformer generation.
epunzal2's Repositories
epunzal2/kalshi-trades
Kalshi Python API + trading
epunzal2/AmarelR
Editing R materials for amarel
epunzal2/AMBER-Umbrella_COM_restraint_tutorial
Tutorial to run AMBER umbrella COM restraint code and derive free energy of transfer profile for methanol through DMPC membrane
epunzal2/chemiscope_visualization
epunzal2/clusfps
A Molecular cluster tools built on RDKit
epunzal2/CompChemScripts
from HaotianZhangAI4Science
epunzal2/deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
epunzal2/demo
BIOINF575 hw1
epunzal2/Financial-Models-Numerical-Methods
Collection of notebooks about quantitative finance, with interactive python code.
epunzal2/matminer-webapp
epunzal2/MDAnalysisCookbook
Examples and tutorials of using MDAnalysis
epunzal2/moon-board-climbing
Forking this climbing repo for further uses
epunzal2/newGitTest
epunzal2/practical_cheminformatics_tutorials
Practical Cheminformatics Tutorials
epunzal2/pymbar
Python implementation of the multistate Bennett acceptance ratio (MBAR)
epunzal2/quantlearning
Learning quant trading basics using Python
epunzal2/Workshop-NumPy
CSCAR workshop for introductory NumPy
epunzal2/DataScienceWorkshop_Fall-2024_NBL
Edited Workshop Materials from Data Science at Rutgers-New Brunswick Libraries (Fall 2024)
epunzal2/docker-cicd
Configure CI/CD for Python app via Docker
epunzal2/mbar_sample_matsunagalab
Input files used in the paper on MBAR by Matsunaga et al.
epunzal2/research_public
Quantitative research and educational materials
epunzal2/sample-molecule-geometries
A collection of input geometries used in https://doi.org/10.26434/chemrxiv.13626083.v1
epunzal2/tidyverse_approach
Editing materials from R workshops
epunzal2/timescaledb-etf-tracker
epunzal2/tsopt_xtb
epunzal2/vim-cheatsheet
📟 My personal vim cheatsheet