mqcomplab
MQ Lab software and projects
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- bblean Public
BitBIRCH-Lean, a memory-efficient implementation of BitBIRCH designed for high-throughput clustering of huge molecular libraries
mqcomplab/bblean’s past year of commit activity - Fanpy Public
Fanpy is a free and open-source Python library for developing and testing multideterminant wavefunctions and related ab initio methods in electronic structure theory.
mqcomplab/Fanpy’s past year of commit activity - CPP-MDANCE Public
A c++ implementation of MDANCE, a flexible n-ary clustering package for all applications
mqcomplab/CPP-MDANCE’s past year of commit activity - TDC Public Forked from mims-harvard/TDC
Therapeutics Commons (TDC): Multimodal Foundation for Therapeutic Science
mqcomplab/TDC’s past year of commit activity - ChemDiversity Public
mqcomplab/ChemDiversity’s past year of commit activity - BitBIRCH_AC Public
mqcomplab/BitBIRCH_AC’s past year of commit activity
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