• 212 359 7379
  • KB 332A
  • basak.koca@boun.edu.tr

Education

  • Ph.D. Candidate Chemistry, Boğaziçi University, 2019 – present
  • M.S. Chemistry, Boğaziçi University, 2019
  • B.S. Chemistry, Istanbul Technical University, 2016

Research Interests

Molecular Modeling and Dynamics of Bioinorganic Systems

Publications

SAMPL7 blind challenge: quantum–mechanical prediction of partition coefficients and acid dissociation constants for small drug-like moleculesFındık, B.K., Haslak, Z.P., Arslan, E., Aviyente, V.Journal of Computer Aided Molecular Design2021, Impact Factor: 2.546, Q2

A Blind SAMPL6 Challenge: Insight Into the Octanol-Water Partition Coefficients of Drug-Like Molecules via a DFT Approach Arslan, E., Findik, B.K., Aviyente, V.Journal of Computer Aided Molecular Design2020, Impact Factor: 3.582, Q2

Organocatalysts in Ring-Opening Polymerization: Revealing Their Effect on Stereochemistry Koca B., Akgul D., Aviyente, V.European Polymer Journal, 121, 2019, Impact Factor: 3.899, Q1

Exploring the Photophysics of Polyfluorinated Phthalocyanine Derivatives as Potential Theranostic Agents Koca, B., Hamuryudan, E., Catak, S., Erdogmus, A., Monari, A., Aviyente, V.The Journal of Physical Chemistry C, 123 (40), 24417-24425, 2019, Impact Factor: 4.537, Q1

Presentations

Florlu Ftalosiyanin Türevlerinin Fotoalgılayıcı Özelliklerine Hesapsal Bakış Koca, B., Hamuryudan, E., Catak, S.,  Erdogmus, A., Monari, A., Aviyente, V., 31. Ulusal Kimya Kongresi, Istanbul, September 10-13, 2019 (Oral Presentation)

Fotodinamik Terapide Işığa Duyarlı Madde Olarak Multiflorosübstitüe Ftalosiyaninler : Hesapsal Bir Çalışma, Koca, B., Catak, S., Monari, A., Aviyente, V., 30. Ulusal Kimya Kongresi, North Cyprus, November 5-8, 2018 (Poster Presentation)

On the Potential Use of Polyfluorinated Dendrimeric Phthalocyanines as Photosensitizers in Photodynamic Therapy: A TD-DFT Survey, Koca, B., Catak, S., Monari, A., Aviyente, V., Chemical Physics Congress, Safranbolu, October 12-13, 2018 (Poster Presentation)

Polyfluorinated Dendrimeric Phthalocyanines as Potential Photosensitizers in Photodynamic Therapy: A Computational Study, Koca, B., Catak, S., Monari, A., Aviyente, V., ESPA 2018, Spain, July 17-19, 2018 (Poster Presentation)