Assessing the ligand native-like pose using a quantum mechanical-derived hydropathic score for protein-ligand complementarity Publications 2026 Assessing the ligand native-like pose using a quantum mechanical-derived hydropathic score for protein-ligand complementarity
Candimine as a natural scaffold for targeting squalene synthetase in Trypanosoma cruzi: insights from computational studies Publications 2026 Candimine as a natural scaffold for targeting squalene synthetase in Trypanosoma cruzi: insights from computational studies
Distinctive behavior and selective modulation of PPARγ by pentacyclic triterpenoid pomolic acid and hederagenin from Rosa canina Publications 2026 Distinctive behavior and selective modulation of PPARγ by pentacyclic triterpenoid pomolic acid and hederagenin from Rosa canina
Design, synthesis, biological evaluation, and in silico analysis of novel antifungal agents targeting Trichophyton species Publications 2026 Design, synthesis, biological evaluation, and in silico analysis of novel antifungal agents targeting Trichophyton species
Spiranic compounds as novel AMPK paradoxical inhibitors: Can we derive new mechanistic insights? Publications 2026 Spiranic compounds as novel AMPK paradoxical inhibitors: Can we derive new mechanistic insights?
How dispersion interactions at the excited state can tune photochromism of embedded chromophores Publications 2026 How dispersion interactions at the excited state can tune photochromism of embedded chromophores
Unraveling charge-transfer states and their ultrafast dynamics in artificial light-harvesting complexes Publications 2026 Unraveling charge-transfer states and their ultrafast dynamics in artificial light-harvesting complexes
