Publications
Conference poster
- Iris Rami; Parveen Gartan; Marie Thiemann et al. (2026). ML vs. physics-based scoring: a case study on antibiotic binding affinity prediction. (external link)
- Parveen Gartan; Charles L. Brooks III; Nathalie Reuter (2024). Investigating Polypharmacology through Targeting Known Human Neutrophil Elastase Inhibitors to Proteinase 3. (external link)
- Parveen Gartan; Charles L. Brooks III; Nathalie Reuter (2025). Binding Affinity Predictions and Alternate Pose Ranking via MSλD. (external link)
- Parveen Gartan; Luis F. Cervantes; Charles L. Brooks III et al. (2023). Confirmation of alternate ligand binding poses to protein using λ dynamics. (external link)
- Mahmoud Moqadam; Parveen Gartan; Reza Talandashti et al. (2024). Release of Ceramide from the CERT START Domain. (external link)
- Parveen Gartan; Fahimeh Khorsand; Pushpak Mizar et al. (2022). Potential dual-inhibitors of human neutrophil elastase and proteinase 3: drug targets for COPD. (external link)
- Parveen Gartan; Luis F. Cervantes; Charles L. Brooks III et al. (2021). Inhibitors of human neutrophil elastase against proteinase 3: A multisite lambda dynamics (MSLD) study. (external link)
Doctoral thesis (PhD)
Academic article
- Mahmoud Moqadam; Parveen Gartan; Reza Talandashti et al. (2024). A Membrane-Assisted Mechanism for the Release of Ceramide from the CERT START Domain. (external link)
- Parveen Gartan; Fahimeh Khorsand; Pushpak Mizar et al. (2024). Investigating Polypharmacology through Targeting Known Human Neutrophil Elastase Inhibitors to Proteinase 3. (external link)
- Parveen Gartan; Charles L. Brooks; Nathalie Reuter (2025). Core Flipping in Lead Optimization: Rank Ordering Using λ-Dynamics. (external link)