kimjc95

Ph.D student in Chemistry

KAISTDaejeon, Republic of Korea

Pinned Repositories

addNewResidue.py
This code adds custom-made amino acids to the GROMACS forcefield directory.
Language:Python8 2 03
computational-chemistry
Google Colaboratory Notebooks for Computational Biochemistry
Language:Jupyter Notebook6 1 02
gmx_cyclizer.py
Script for generating cyclic peptide's topology in GROMACS versions < 2021
Language:Python1 1 00
kimjc95.github.io
:triangular_ruler: Jekyll theme for building a personal site, blog, project documentation, or portfolio.
Language:Jupyter Notebook0 0 00
openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
Language:C++1.1k 70 1.9k420
openmm-ml
High level API for using machine learning models in OpenMM simulations
Language:Python85 13 5526
openmm-xtb
OpenMM plugin to interface with XTB
Language:C++13 4 52

kimjc95/addNewResidue.py
This code adds custom-made amino acids to the GROMACS forcefield directory.
Language:Python8 2 03
kimjc95/computational-chemistry
Google Colaboratory Notebooks for Computational Biochemistry
Language:Jupyter Notebook6 1 02
kimjc95/gmx_cyclizer.py
Script for generating cyclic peptide's topology in GROMACS versions < 2021
Language:Python1 1 00
kimjc95/kimjc95.github.io
:triangular_ruler: Jekyll theme for building a personal site, blog, project documentation, or portfolio.
Language:Jupyter Notebook0 0 00