Journal: Journal of Computational Chemistry
Loading...
Abbreviation
J Comput Chem
Publisher
Wiley
73 results
Search Results
Publications 1 - 10 of 73
- On searching in, sampling of, and dynamically moving through conformational space of biomolecular systemsItem type: Review Article
- Haptic quantum chemistryItem type: Journal Article
- A biomolecular force field based on the free enthalpy of hydration and solvationItem type: Journal Article
- Code Interoperability and Standard Data Formats in Quantum Chemistry and Quantum DynamicsItem type: Journal Article
- Comparison of three enveloping distribution sampling Hamiltonians for the estimation of multiple free energy differences from a single simulationItem type: Journal Article
- Quantum chemical calculation of vibrational spectra of large molecules—Raman and IR spectra for BuckminsterfullereneItem type: Journal Article
- New functionalities in the GROMOS biomolecular simulation softwareItem type: Journal Article
- Using the Local Elevation Method to Construct Optimized Umbrella Sampling PotentialsItem type: Journal Article
- Software News and Updates The MP2-F12 Method in the TURBOMOLE Program PackageItem type: Journal Article
- A novel approach for designing simple point charge models for liquid water with three interaction sitesItem type: Journal Article
Publications 1 - 10 of 73