The BLUES Report: Towards fragment binding mode occupancies

Autor: Mobley, David L, Lim, Nathan M, Gill, Samuel L, Bayly, Christopher I, Warren, Gregory

Publikováno v: Mobley, David L; Lim, Nathan M; Gill, Samuel L; Bayly, Christopher I; & Warren, Gregory. (2018). The BLUES Report: Towards fragment binding mode occupancies. UC Irvine: Department of Pharmaceutical Sciences, UCI. Retrieved from: http://www.escholarship.org/uc/item/1d84z259

This is a talk/status report given on our BLUES technique for estimating fragment binding mode occupancies; it was presented at the OpenEye CUP Meeting in Santa Fe, NM, March 8, 2018. This work is in the area of structure-based drug design and we are

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=od_______325::c81150be9a919e99bb43128e5df48d2b
http://www.escholarship.org/uc/item/1d84z259