I may be slow to respond.
Computational Chemistry and ML researcher at GSK, PhD in computational physical chemistry. Python; Fortran, C
-
GSK
- Stevenage, UK
- www.linkedin.com/in/damien-coupry-88309642
Block or Report
Block or report DCoupry
Report abuse
Contact GitHub support about this user’s behavior. Learn more about reporting abuse.
Report abusePopular repositories Loading
-
ChemDist_paper
ChemDist_paper PublicCode and material necessary for the reproduction of the results in the paper "Application of deep metric learning to molecular similarity".
-
GenAlgHbond
GenAlgHbond PublicA genetic algorithm toy example for finding optimal solvent positions in a MOF by maximizing the number of possible hydrogen bonds.
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.