Items where Author is "Mobley, David L."

Journal Article

D’Amore, Lorenzo and Hahn, David F. and Dotson, David L. and Horton, Joshua T. and Anwar, Jamshed and Craig, Ian and Fox, Thomas and Gobbi, Alberto and Lakkaraju, Sirish Kaushik and Lucas, Xavier and Meier, Katharina and Mobley, David L. and Narayanan, Arjun and Schindler, Christina E. M. and Swope, William C. and in ’t Veld, Pieter J. and Wagner, Jeffrey and Xue, Bai and Tresadern, Gary (2022) Collaborative Assessment of Molecular Geometries and Energies from the Open Force Field. Journal of Chemical Information and Modeling, 62 (23). pp. 6094-6104. ISSN 1549-9596

Horton, Joshua T. and Boothroyd, Simon and Wagner, Jeffrey and Mitchell, Joshua A. and Gokey, Trevor and Dotson, David L. and Behara, Pavan Kumar and Ramaswamy, Venkata Krishnan and Mackey, Mark and Chodera, John D. and Anwar, Jamshed and Mobley, David L. and Cole, Daniel J. (2022) Open Force Field BespokeFit: Automating Bespoke Torsion Parametrization at Scale. Journal of Chemical Information and Modeling, 62 (22). pp. 5622-5633. ISSN 1549-9596