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Industrial & Engineering Chemistry Research|September 16, 2021
Combined GCMC, MD, and DFT Approach for Unlocking the Performances of COFs for Methane PurificationOmer Faruk Altundal, Zeynep Pinar Haslak, Seda KeskinMaterials Advances|April 3, 2025
Rational design of lanthanide-based metal-organic frameworks for CO2 capture using computational modelingZeynep Pinar Haslak, Hasan Can Gulbalkan, Seda KeskinJournal of Computer-Aided Molecular Design|June 24, 2021
SAMPL7 blind challenge: quantum-mechanical prediction of partition coefficients and acid dissociation constants for small drug-like moleculesBasak Koca Fındık, Zeynep Pinar Haslak, Evrim Arslan, et al.Organic & Biomolecular Chemistry|May 18, 2023
DNA preference of indenoisoquinolines: a computational approachSemiha Kevser Bali, Zeynep Pinar Haslak, Gulsah Cifci, et al.ACS Applied Materials & Interfaces|March 1, 2025
Harnessing Pore Size in COF Membranes: A Concentration Gradient-Driven Molecular Dynamics Study on Enhanced H2/CH4 SeparationParivash Jamshidi Ghaleh, Zeynep Pinar Haslak, Merdan Batyrow, et al.Journal of Chemical Information and Modeling|June 17, 2021
Using Atomic Charges to Describe the pKa of Carboxylic AcidsZeynep Pinar Haslak, Sabrina Zareb, Ilknur Dogan, et al.Journal of Chemical Information and Modeling|May 1, 2023
Quantum Mechanical Prediction of Dissociation Constants for Thiazol-2-imine DerivativesEvrim Arslan, Zeynep Pinar Haslak, Gérald Monard, et al.Journal of Structural Biology|March 27, 2026
Binding of the elastin peptide VGVAPG and lactose to the human elastin binding proteinZeynep Pinar Haslak, Nicolas Belloy, Laurent Debelle, et al.ACS Omega|February 23, 2026
Integrated Experimental and Computational Insights into the Systematic Synthesis of Cyclodextrin-based MOFBusra Ipek, Zeynep Pinar Haslak, Bünyemin Cosut, et al.Organic & Biomolecular Chemistry|December 20, 2024
Origins of the substituent effects in the aldol condensation of axially chiral thiohydantoins: a computational studyNazli Goksel Carpa, Zekihan Ozerdem, Ilknur Dogan, et al.Pageof 2