POVME 2.0: An Enhanced Tool for Determining Pocket Shape and Volume Characteristics
Jacob D. Durrant(University of California San Diego), Lane Votapka(University of California San Diego), Jesper Givskov Sørensen(University of California San Diego), Rommie E. Amaro(University of California San Diego)
Cited by 241Open Access
Abstract
, the etiological agent of African sleeping sickness. The POVME analysis characterizes the full dynamics of a potentially druggable transient binding pocket and so may guide future antitrypanosomal drug-discovery efforts. We are hopeful that this new version will be a useful tool for the computational- and medicinal-chemist community.
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