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104. Reaction of nitrones with silyl ketene acetals: A DFT study.

105. Insight into the Reactivity of Olefins in the Pauson­Khand Reaction.

106. Some problems with the accuracy in ab initio calculations of the static dipole polarizability components: example of the OH− ion

107. The OH−(H2O)2 system: efficiency of ab initio and DFT calculations for two- and three-body interactions

109. Theoretical Study of the Regiochemistry-Determining Step of the Pauson-Khand Reaction.

111. Reversible dimerization of viologen radicals covalently linked to a calixarene platform: Experimental and theoretical aspects.

112. Investigating the interplay between charge transfer and CO 2 insertion in the adsorption of a NiFe catalyst for CO 2 electroreduction on a graphite support through DFT computational approaches.

113. Did Homocysteine Take Part in the Start of the Synthesis of Peptides on the Early Earth?

114. A way to thioacetate esters compatible with non-oxidative prebiotic conditions.

115. Experimental and computational insights into carbon dioxide fixation by RZnOH species.

116. Kinetic resolution in the [2+2] cycloaddition of ketenes: an experimental and theoretical study.

117. Conformational flexibility of human casein kinase catalytic subunit explored by metadynamics.

118. Water surface is acidic.

119. Structural, kinetic, and theoretical studies on models of the zinc-containing phosphodiesterase active center: medium-dependent reaction mechanisms.

121. On early events in the Pauson-Khand reaction.

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