Pinned Repositories
21SummerCodingCamp
2021 Summer // Kim & Paton Group Coding Camp Materials
aqme
Automated Quantum Mechanical Environments (AQME) offers transparent and reproducible workflows available for Jupyter Notebooks and command lines, including: 1) RDKit- and CREST-based conformer generation, 2) QM input file creation, 3) post-processing of QM output files, 4) generation of xTB, DFT and RDKit descriptors
bioinformatics
Chem571B_21Fall
codingcamp
PD1
Look in README.md for more info
theory-suite-wiki
This repository holds the source files and html files of a documentation webpage made by the members of the Patonlab and BioE-KimLab at CSU
xygen34's Repositories
xygen34/theory-suite-wiki
This repository holds the source files and html files of a documentation webpage made by the members of the Patonlab and BioE-KimLab at CSU
xygen34/21SummerCodingCamp
2021 Summer // Kim & Paton Group Coding Camp Materials
xygen34/aqme
Automated Quantum Mechanical Environments (AQME) offers transparent and reproducible workflows available for Jupyter Notebooks and command lines, including: 1) RDKit- and CREST-based conformer generation, 2) QM input file creation, 3) post-processing of QM output files, 4) generation of xTB, DFT and RDKit descriptors
xygen34/bioinformatics
xygen34/Chem571B_21Fall
xygen34/codingcamp
xygen34/PD1
Look in README.md for more info