Parallel Genetic Algorithms for Crystal Structure Prediction: Successes and Failures in Predicting Bicalutamide Polymorphs. - Marta B. Ferraro; Anita M. Orendt; Julio C. Facelli (ICIC (1), 2009)

Crystal structure prediction of flexible molecules using parallel genetic algorithms with a standard force field. - Seonah Kim; Anita M. Orendt; Marta B. Ferraro; Julio C. Facelli (J. Comput. Chem., 2009)

Quantum mechanically derived AMBER-compatible heme parameters for various states of the cytochrome P450 catalytic cycle. - Kiumars Shahrokh; Anita M. Orendt; Garold S. Yost; Thomas E. Cheatham III (J. Comput. Chem., 2012)

Measuring the Impact of Facilitation Effort. - Anita M. Orendt; Erin Shaw (PEARC, 2018)

Improving regional cyberinfrastructure services through collaboration: Cyberteam for the Rocky Mountain Advanced Computing Consortium. - Andrew J. Monaghan; Brett Milash; Tobin Magle; Thomas Hauser; Thomas E. Cheatham; Patrick J. Burns; Shelley Knuth; Anita M. Orendt; Suzi White; Dawn Paschal; Howard Jay Siegel; Timothy Kaiser; et al. (PEARC, 2019)

An open science grid implementation of the steady state genetic algorithm for crystal structure prediction. - Kristal N. Varela; Gabriel I. Pagola; Albert M. Lund; Marta B. Ferraro; Anita M. Orendt; Julio C. Facelli (J. Comput. Sci., 2024)