@testusersimtech

Gaussian Process Regression for Transition State Search

, and . Journal of Chemical Theory and Computation, 14 (11): 5777-5786 (2018)
DOI: 10.1021/acs.jctc.8b00708

Links and resources

Tags

community

  • @testusersimtech
  • @unibiblio
  • @jkaestner
  • @simtech
  • @exc2075
@testusersimtech's tags highlighted