The BOS-Lig dataset assigns net charges to 66,810 ligands from experimental transition metal complexes via a consensus charge-balancing workflow that starts with homoleptic cases and propagates to heteroleptic ones.
Alkyl-Substituted Bipyridyl Platinum (Ii) Complexes Bearing Alkynyl-Naphthalimide Ligands: Synthesis, Photophysical Properties, and Tunable Aggregation-Induced Emission Activity
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The BOS-Lig Dataset: Accurate Ligand Charges from a Consensus Approach for 66,810 Experimentally Synthesized Ligands
The BOS-Lig dataset assigns net charges to 66,810 ligands from experimental transition metal complexes via a consensus charge-balancing workflow that starts with homoleptic cases and propagates to heteroleptic ones.