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ORCID"An improved algorithm for analytical gradient evaluation in ..."
Robert A. Distasio Jr. et al. (2007)
- Robert A. Distasio Jr., Ryan P. Steele, Young Min Rhee
, Yihan Shao, Martin Head-Gordon:
An improved algorithm for analytical gradient evaluation in resolution-of-the-identity second-order Møller-Plesset perturbation theory: Application to alanine tetrapeptide conformational analysis. J. Comput. Chem. 28(5): 839-856 (2007)
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