Login / Signup

SAMPL4, a blind challenge for computational solvation free energies: the compounds considered.

J. Peter Guthrie
Published in: J. Comput. Aided Mol. Des. (2014)
Keyphrases
  • data structure
  • experimental data
  • mathematical programming
  • neural network
  • image processing
  • website
  • evolutionary algorithm
  • cutting plane