Florentina Tofoleanu

Publication Activity (10 Years)

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

Top Topics

Molecular Docking

Structural Basis

Top Venues

Journal of computer-aided molecular design

This page only lists publications with an associated author ORCID identifier.

Publications

Naohiro Nishikawa, Kyungreem Han, Xiongwu Wu, Florentina Tofoleanu, Bernard R Brooks
Comparison of the umbrella sampling and the double decoupling method in binding free energy predictions for SAMPL6 octa-acid host-guest challenges. Journal of computer-aided molecular design 32 (10) (2018)
Kyungreem Han, Phillip S Hudson, Michael R Jones, Naohiro Nishikawa, Florentina Tofoleanu, Bernard R Brooks
Prediction of CB[8] host-guest binding free energies in SAMPL6 using the double-decoupling method. Journal of computer-aided molecular design 32 (10) (2018)
Florentina Tofoleanu, Juyong Lee, Frank C Pickard Iv, Gerhard König, Jing Huang, Minkyung Baek, Chaok Seok, Bernard R Brooks
Absolute binding free energies for octa-acids and guests in SAMPL5 : Evaluating binding free energies for octa-acid and guest complexes in the SAMPL5 blind challenge. Journal of computer-aided molecular design 31 (1) (2016)