Sensitivity Analysis in Biomolecular Simulation

This publication has 79 references indexed in Scilit:

• The folding of an enzyme: I. Theory of protein engineering analysis of stability and pathway of protein folding
  Published by Elsevier ,2004
• Walking on the free energy hypersurface of the 18-crown-6 ion system using free energy derivatives
  The Journal of Chemical Physics, 1994
• An Anisotropic Polarizable Water Model: Incorporation of All-Atom Polarizabilities into Molecular Mechanics Force Fields
  The Journal of Physical Chemistry, 1994
• Sensitivity analysis of distribution functions of liquid water
  The Journal of Chemical Physics, 1993
• Essential dynamics of proteins
  Proteins-Structure Function and Bioinformatics, 1993
• A well-behaved electrostatic potential based method using charge restraints for deriving atomic charges: the RESP model
  The Journal of Physical Chemistry, 1993
• A new flexible/polarizable water model
  The Journal of Chemical Physics, 1991
• Protein normal-mode dynamics: Trypsin inhibitor, crambin, ribonuclease and lysozyme
  Journal of Molecular Biology, 1985
• Comparison of simple potential functions for simulating liquid water
  The Journal of Chemical Physics, 1983
• CHARMM: A program for macromolecular energy, minimization, and dynamics calculations
  Journal of Computational Chemistry, 1983