Effect of Metal Ions (Li+, Na+, K+, Mg2+, Ca2+, Ni2+, Cu2+, and Zn2+) and Water Coordination on the Structure of Glycine and Zwitterionic Glycine von Remko, Milan, Rode, Bernd Michael

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Effect of metal ions (Li⁺, Na⁺, K⁺, Mg²⁺, Ca²⁺, Ni²⁺, Cu²⁺ and Zn²⁺) and water coordination on the structure and properties of l-histidine and zwitterionic l-histidine... von Remko, Milan, Fitz, Daniel, Rode, Bernd Michael

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Effect of Metal Ions (Li+, Na+, K+, Mg2+, Ca2+, Ni2+, Cu2+, and Zn2+) and Water Coordination on the Structure and Properties of l-Arginine and Zwitterionic l-Arginine von Remko, Milan, Fitz, Daniel, Rode, Bernd Michael

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The role of non-additive contributions on the hydration shell structure of Mg2+ studied by Born-Oppenheimer ab initio quantum mechanical/molecular mechanical molecular dynamics sim... von TONGRAAR, Anan, RODE, Bernd Michael

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A Combined QM/MM Molecular Dynamics Simulations Study of Nitrate Anion (NO3 -) in Aqueous Solution von Tongraar, Anan, Tangkawanwanit, Piyawan, Rode, Bernd Michael

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Ab initio QM/MM molecular dynamics simulation of preferential K+ solvation in aqueous ammonia solution von TONGRAAR, Anan, RODE, Bernd Michael

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QM/MM MD Simulations of Iodide Ion (I−) in Aqueous Solution: A Delicate Balance between Ion−Water and Water−Water H-Bond Interactions von Tongraar, Anan, Hannongbua, Supot, Rode, Bernd Michael

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Combined QM/MM MD Study of HCOO−−Water Hydrogen Bonds in Aqueous Solution von Payaka, Apirak, Tongraar, Anan, Rode, Bernd Michael

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Chemical evolution toward the origin of life von Fitz, Daniel, Reiner, Hannes, Rode, Bernd Michael

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The hydration structures of F- and Cl- investigated by ab initio QM/MM molecular dynamics simulations von TONGRAAR, Anan, RODE, Bernd Michael

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Prebiotic Formation of Amino Acids in a Neutral Atmosphere by Electric Discharge von Plankensteiner, Kristof, Reiner, Hannes, Schranz, Benjamin, Rode, Bernd Michael

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Dynamical properties of water molecules in the hydration shells of Na + and K +: ab initio QM/MM molecular dynamics simulations von Tongraar, Anan, Michael Rode, Bernd

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The Possible Influence of L-Histidine on the Origin of the First Peptides on the Primordial Earth von Reiner, Hannes, Plankensteiner, Kristof, Fitz, Daniel, Rode, Bernd Michael

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The possible role of Cu(II) for the origin of life von Rode, Bernd Michael, Suwannachot, Yuttana

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A Born−Oppenheimer Ab Initio Quantum Mechanical/Molecular Mechanical Molecular Dynamics Simulation on Preferential Solvation of Na+ in Aqueous Ammonia Solution von Tongraar, Anan, Rode, Bernd Michael

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On the mechanisms of oligopeptide reactions in solution and clay dispersion von Bujdák, Juraj, Rode, Bernd Michael

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Preferential solvation of Ca2+ in aqueous ammonia solution: Classical and combined ab initio quantum mechanical/molecular mechanical molecular dynamics simulations von Tongraar, Anan, Sagarik, Kritsana, Michael Rode, Bernd

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Effect of metal Ions (Ni2+, Cu2+ and Zn2+) and water coordination on the structure of L-phenylalanine, L-tyrosine, L-tryptophan and their zwitterionic forms von Remko, Milan, Fitz, Daniel, Broer, Ria, Rode, Bernd Michael

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How Acidic Are the Selenocarboxylic Acids RCSeOH and RCOSeH (R = H, F, Cl, NH2, CH3)? von Remko, Milan, Rode, Bernd Michael

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The Possible Influence ofL-Histidine on the Origin of the First Peptides on the Primordial Earth von Reiner, Hannes, Plankensteiner, Kristof, Fitz, Daniel, Rode, Bernd Michael

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