Research
QCMM-2022
People
News
Seminars
Publications
Resources
Contact

SAMPL6 Octanol–water partition coefficients from alchemical free energy calculations with MBIS atomic charges

Publications

20 - January - 2020

The Quantum Chemistry and Molecular Modeling group at Universidad de Concepción is dedicated to advancing chemical knowledge through the use of cutting edge computational and theoretical methods.

QCMM 2020

Departamento de Físico-Química Facultad de Ciencias Químicas Universidad de Concepción.

Edmundo Larenas 129. Concepción +56412204324 qcmm@udec.cl

Research

Tweets by vohringerlab