9 projects
mrich
Pretty-printing wrappers around Rich
richqueue
RichQueue
MolParse
Package for parsing, writing, and modifying molecular structure files
hippo-db
Hit Interaction Profiling and Procurement Optimisation
MPyTools
Convenient tools for CLI, GUI, and plotting
MuCOS
Multi-SuCOS: Score derivative compounds based how well they recapitulate the shape and colour of multiple (fragment) inspiration hits
hirsch
Abstracted, continuous, and normalised of version of the Hirsch index (h-index) from academic writing for use as a statistical measure of even distribution
hippo-plot
Lightweight companion to HIPPO for creating interactive data visualisations of HIPPO outputs
PoseButcher
A tool for categorising and segmenting virtual hits with reference to experimental protein structures and (fragment) hits.