Other publications in Journal of computer-aided molecular design

Development of SAAP3D force field and the application to replica-exchange Monte Carlo simulation for...

Published in Nov 17, 2017

Lessons learned from participating in D3R 2016 Grand Challenge 2: compounds targeting the farnesoid...

Published in Nov 10, 2017

New insights into flavivirus biology: the influence of pH over interactions between prM and E protei...

Published in Nov 01, 2017

Identification of the quinolinedione inhibitor binding site in Cdc25 phosphatase B through docking a...

Published in Nov 01, 2017

Comparing pharmacophore models derived from crystallography and NMR ensembles.

Published in Nov 01, 2017