Salomon R. Billeter
Publications by Year
Research Areas
Spectroscopy and Quantum Chemical Studies, Advanced Chemical Physics Studies, Advanced NMR Techniques and Applications, Semiconductor materials and devices, Photochemistry and Electron Transfer Studies
Most-Cited Works
- → The GROMOS Biomolecular Simulation Program Package(1999)1,494 cited
- → QUASI: A general purpose implementation of the QM/MM approach and its application to problems in catalysis(2003)1,038 cited
- → Linear scaling geometry optimisation and transition state search in hybrid delocalised internal coordinates(2000)459 cited
- → Network of coupled promoting motions in enzyme catalysis(2002)459 cited
- → Efficient linear scaling geometry optimization and transition-state search for direct wavefunction optimization schemes in density functional theory using a plane-wave basis(2003)218 cited
- → Hydride Transfer in Liver Alcohol Dehydrogenase: Quantum Dynamics, Kinetic Isotope Effects, and Role of Enzyme Motion(2001)204 cited
- → Nuclear Quantum Effects and Enzyme Dynamics in Dihydrofolate Reductase Catalysis(2002)186 cited
- → Hybrid approach for including electronic and nuclear quantum effects in molecular dynamics simulations of hydrogen transfer reactions in enzymes(2001)124 cited
- → Ab initioderived augmented Tersoff potential for silicon oxynitride compounds and their interfaces with silicon(2006)67 cited
- → Can the density maximum of water be found by computer simulation?(1994)59 cited