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bernd m rode
bernd m rode
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Verified email at uibk.ac.at
Title
Cited by
Cited by
Year
Peptides and the origin of life1
BM Rode
Peptides 20 (6), 773-786, 1999
3971999
Characterization of dynamics and reactivities of solvated ions by ab initio simulations
TS Hofer, HT Tran, CF Schwenk, BM Rode
Journal of computational chemistry 25 (2), 211-217, 2004
2832004
Born−Oppenheimer ab Initio QM/MM Dynamics Simulations of Na+ and K+ in Water:  From Structure Making to Structure Breaking Effects
A Tongraar, KR Liedl, BM Rode
The Journal of Physical Chemistry A 102 (50), 10340-10347, 1998
2621998
A QM/MM simulation method applied to the solution of Li+ in liquid ammonia
T Kerdcharoen, KR Liedl, BM Rode
Chemical physics 211 (1-3), 313-323, 1996
2171996
Molecular dynamics and x-ray investigation of an aqueous calcium chloride solution
MM Probst, T Radnai, K Heinzinger, P Bopp, BM Rode
The Journal of Physical Chemistry 89 (5), 753-759, 1985
2081985
Ab initio quantum mechanical charge field (QMCF) molecular dynamics: a QM/MM–MD procedure for accurate simulations of ions and complexes
BM Rode, TS Hofer, BR Randolf, CF Schwenk, D Xenides, ...
Theoretical Chemistry Accounts 115, 77-85, 2006
1962006
Effect of metal ions (Li+, Na+, K+, Mg2+, Ca2+, Ni2+, Cu2+, and Zn2+) and water coordination on the structure of glycine and zwitterionic glycine
M Remko, BM Rode
The Journal of Physical Chemistry A 110 (5), 1960-1967, 2006
1922006
Coordination and ligand exchange dynamics of solvated metal ions
BM Rode, CF Schwenk, TS Hofer, BR Randolf
Coordination Chemistry Reviews 249 (24), 2993-3006, 2005
1912005
Solvation of Ca2+ in Water Studied by Born−Oppenheimer ab Initio QM/MM Dynamics
A Tongraar, KR Liedl, BM Rode
The Journal of Physical Chemistry A 101 (35), 6299-6309, 1997
1701997
Molecular dynamics simulations of in water: Comparison of a classical simulation including three-body corrections and Born–Oppenheimer ab initio and …
CF Schwenk, HH Loeffler, BM Rode
The Journal of Chemical Physics 115 (23), 10808-10813, 2001
1562001
The hydration structure of the lithium ion
HH Loeffler, BM Rode
The Journal of chemical physics 117 (1), 110-117, 2002
1522002
Structure of liquid N, N-dimethylformamide studied by means of X-ray diffraction.
H Ohtaki, S Itoh, T Yamaguchi, S Ishiguro, BM Rode
Bulletin of the Chemical Society of Japan 56 (11), 3406-3409, 1983
1431983
Structure and Dynamics of Sulfate Ion in Aqueous SolutionAn ab initio QMCF MD Simulation and Large Angle X-ray Scattering Study
V Vchirawongkwin, BM Rode, I Persson
The Journal of Physical Chemistry B 111 (16), 4150-4155, 2007
1312007
The structure of liquid formamide studied by means of X-ray diffraction and ab initio LCGO-MO-SCF calculations.
H Ohtaki, A Funaki, BM Rode, GJ Reibnegger
Bulletin of the Chemical Society of Japan 56 (7), 2116-2121, 1983
1261983
Structure and ultrafast dynamics of liquid water: A quantum mechanics/molecular mechanics molecular dynamics simulations study
D Xenides, BR Randolf, BM Rode
The Journal of chemical physics 122 (17), 2005
1222005
Possible role of copper and sodium chloride in prebiotic evolution of peptides
MG Schwendinger, BM Rode
Analytical Sciences 5 (4), 411-414, 1989
1171989
The influence of Li+, Na+, Mg2+, Ca2+, and Zn2+ ions on the hydrogen bonds of the Watson–Crick base pairs
EHS Anwander, MM Probst, BM Rode
Biopolymers: Original Research on Biomolecules 29 (4‐5), 757-769, 1990
1141990
“Structure Breaking” Effect of Hydrated Cs+
CF Schwenk, TS Hofer, BM Rode
The Journal of Physical Chemistry A 108 (9), 1509-1514, 2004
1122004
Silica, alumina and clay catalyzed peptide bond formation: enhanced efficiency of alumina catalyst
J Bujdák, BM Rode
Origins of Life and Evolution of the Biosphere 29, 451-461, 1999
1121999
Automated docking of ligands to antibodies: methods and applications
CA Sotriffer, W Flader, RH Winger, BM Rode, KR Liedl, JM Varga
Methods 20 (3), 280-291, 2000
1112000
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