Majda Misini Ignjatovic

Publication Activity (10 Years)

Years Active: 2016-2018
Publications (10 Years): 3

Top Topics

Grand Challenge

Clinical Setting

Multiresolution

Top Venues

J. Comput. Aided Mol. Des.

J. Comput. Chem.

Publications

Octav Caldararu, Martin A. Olsson, Majda Misini Ignjatovic, Meiting Wang, Ulf Ryde
Binding free energies in the SAMPL6 octa-acid host-guest challenge calculated with MM and QM methods. J. Comput. Aided Mol. Des. 32 (10) (2018)
Majda Misini Ignjatovic, Paulius Mikulskis, Pär Söderhjelm, Ulf Ryde
Can MM/GBSA calculations be sped up by system truncation? J. Comput. Chem. 39 (7) (2018)
Majda Misini Ignjatovic, Octav Caldararu, Geng Dong, Camila Muñoz-Gutiérrez, Francisco Adasme-Carreño, Ulf Ryde
Binding-affinity predictions of HSP90 in the D3R Grand Challenge 2015 with docking, MM/GBSA, QM/MM, and free-energy simulations. J. Comput. Aided Mol. Des. 30 (9) (2016)