Potential Energy and Free Energy Surfaces of All Ten Canonical and Methylated Nucleic Acid Base Pairs: Molecular Dynamics and Quantum Chemical ab Initio Studies

This publication has 16 references indexed in Scilit:

• Hoogsteen and Stacked Structures of the 9-Methyladenine···1-Methylthymine Pair Are Populated Equally at Experimental Conditions: Ab Initio and Molecular Dynamics Study
  The Journal of Physical Chemistry A, 2001
• Methylated uracil dimers: potential energy and free energy surfaces
  Physical Chemistry Chemical Physics, 2000
• Global Minimum of the Adenine···Thymine Base Pair Corresponds Neither to Watson−Crick Nor to Hoogsteen Structures. Molecular Dynamic/Quenching/AMBER and ab Initio beyond Hartree−Fock Studies
  Journal of the American Chemical Society, 2000
• Anions of the Hydrogen-Bonded Uracil Dimer. Ab Initio Theoretical Study
  The Journal of Physical Chemistry A, 1999
• Uracil Dimer: Potential Energy and Free Energy Surfaces. Ab Initio beyond Hartree−Fock and Empirical Potential Studies
  The Journal of Physical Chemistry A, 1998
• Competition between H-bonded and stacked dimers of pyrimidine: IR and theoretical ab-initio study
  Molecular Physics, 1997
• Gas-Phase Solvation of Benzene by 2-8 Argon Atoms. A Molecular Dynamics Study with ab Initio Intermolecular Potential
  The Journal of Physical Chemistry, 1995
• Laser Separation of Geometrical Isomers of Weakly Bound Molecular Complexes
  Science, 1995
• A well-behaved electrostatic potential based method using charge restraints for deriving atomic charges: the RESP model
  The Journal of Physical Chemistry, 1993
• Experimental studies of molecular interactions between nitrogen bases of nucleic acids
  Biopolymers, 1979