Excited-state proton coupled electron transfer between photolyase and the damaged DNA through water wire: a photo-repair mechanism

Separation of photo-induced radical pair in cryptochrome to a functionally critical distance

(2014) Ilia A. Solov'yov et al.   Scientific Reports

Challenges in Computing Electron-Transfer Energies of DNA Repair Using Hybrid QM/MM Models

(2013) Abdul Rehaman Moughal Shahi et al.   Journal of Chemical Theory and Computation

Photoinduced Electron Transfer Facilitates Tautomerization of the Conserved Signaling Glutamine Side Chain in BLUF Protein Light Sensors

(2013) M. G. Khrenova et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Dynamic determination of the functional state in photolyase and the implication for cryptochrome

(2013) Z. Liu et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Decrypting Cryptochrome: Revealing the Molecular Identity of the Photoactivation Reaction

(2012) Ilia A. Solov’yov et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dynamics and Mechanism of DNA Repair in a Biomimetic System: Flavin–Thymine Dimer Adduct

(2012) Ya-Ting Kao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electron Tunneling Pathways and Role of Adenine in Repair of Cyclobutane Pyrimidine Dimer by DNA Photolyase

(2012) Zheyun Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electronic Excited States Responsible for Dimer Formation upon UV Absorption Directly by Thymine Strands: Joint Experimental and Theoretical Study

(2012) Akos Banyasz et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

DNA photolyase: Is the nonproductive back electron transfer really much slower than forward transfer?

(2012) K. Brettel et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Reply to Brettel and Byrdin: On the efficiency of DNA repair by photolyase

(2012) D. Zhong et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

An AIMD Study of CPD Repair Mechanism in Water: Role of Solvent in Ring Splitting

(2011) Ali A. Hassanali et al.   JOURNAL OF PHYSICAL CHEMISTRY B

An AIMD Study of the CPD Repair Mechanism in Water: Reaction Free Energy Surface and Mechanistic Implications

(2011) Ali A. Hassanali et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Neutral Histidine and Photoinduced Electron Transfer in DNA Photolyases

(2011) Tatiana Domratcheva   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Watching DNA repair in real time

(2011) A. Stuchebrukhov   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Dynamics and mechanism of cyclobutane pyrimidine dimer repair by DNA photolyase

(2011) Z. Liu et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Reaction mechanisms of DNA photolyase

(2010) Klaus Brettel et al.   CURRENT OPINION IN STRUCTURAL BIOLOGY

What Is Adenine Doing in Photolyase?

(2010) Angela Acocella et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Importance of the Intramolecular Hydrogen Bond on the Photochemistry of Anionic Hydroquinone (FADH−) in DNA Photolyase

(2010) Yue-Jie Ai et al.   Journal of Physical Chemistry Letters

Cyclobutane Pyrimidine Photodimerization of DNA/RNA Nucleobases in the Triplet State

(2010) Teresa Climent et al.   Journal of Physical Chemistry Letters

Ultrafast solvation dynamics at binding and active sites of photolyases

(2010) C.-W. Chang et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Electron tunneling in respiratory complex I

(2010) T. Hayashi et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Steering Electrons on Moving Pathways

(2009) David N. Beratan et al.   ACCOUNTS OF CHEMICAL RESEARCH

MOLCAS 7: The Next Generation

(2009) Francesco Aquilante et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Thymine Dimerization in DNA Model Systems: Cyclobutane Photolesion Is Predominantly Formed via the Singlet Channel

(2009) Wolfgang J. Schreier et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanisms of proton transfer in proteins: Localized charge transfer versus delocalized soliton transfer

(2009) Alexei A. Stuchebrukhov   PHYSICAL REVIEW E

DNA nucleobase properties and photoreactivity: Modeling environmental effects

(2009) Daniel Roca-Sanjuán et al.   PURE AND APPLIED CHEMISTRY

A QM/MM Investigation of Thymine Dimer Radical Anion Splitting Catalyzed by DNA Photolyase

(2008) Fanny Masson et al.   CHEMPHYSCHEM

Computational Study of Thymine Dimer Radical Anion Splitting in the Self-Repair Process of Duplex DNA

(2008) Fanny Masson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ultrafast Dynamics of Flavins in Five Redox States

(2008) Ya-Ting Kao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A Doorway State Leads to Photostability or Triplet Photodamage in Thymine DNA

(2008) Wai-Ming Kwok et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY