Computational Chemistry PhD Student at the University of Bath
-
University of Bath
- https://orcid.org/0009-0001-9811-8335
Popular repositories Loading
-
GoodVibes
GoodVibes PublicForked from patonlab/GoodVibes
Calculate quasi-harmonic free energies from Gaussian output files with temperature and other corrections
Python
-
LModeA-nano
LModeA-nano PublicForked from smutao/LModeA-nano
calculate chemical bond strength in solids, surfaces and molecules
Python
-
aqme
aqme PublicForked from jvalegre/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 gene…
Python
Something went wrong, please refresh the page to try again.
If the problem persists, check the GitHub status page or contact support.
If the problem persists, check the GitHub status page or contact support.