Self-avoiding walk between two fixed points as a tool to calculate reaction paths in large molecular systems
- 17 March 1990
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 38 (S24) , 167-185
- https://doi.org/10.1002/qua.560382419
Abstract
No abstract availableKeywords
This publication has 15 references indexed in Scilit:
- Finding saddle points for clustersThe Journal of Chemical Physics, 1989
- An algorithm for the location of transition statesJournal of Computational Chemistry, 1986
- On finding stationary states on large-molecule potential energy surfacesThe Journal of Physical Chemistry, 1985
- Search for stationary points on surfacesThe Journal of Physical Chemistry, 1985
- CHARMM: A program for macromolecular energy, minimization, and dynamics calculationsJournal of Computational Chemistry, 1983
- Analysis of an energy minimization method for locating transition states on potential energy hypersurfacesChemical Physics Letters, 1980
- Protein foldingQuarterly Reviews of Biophysics, 1977
- A solution for the best rotation to relate two sets of vectorsActa Crystallographica Section A, 1976
- Reaction path properties on potential surfacesThe Journal of Chemical Physics, 1976
- Fluctuations and Irreversible ProcessesPhysical Review B, 1953