Ana Borba

Catalytic enantiocontrol over a non-classical carbocation

PACKMOL: A package for building initial configurations for molecular dynamics simulations

London Dispersion in Molecular Chemistry—Reconsidering Steric Effects

Chirality Transfer in a Methyl Lactate–Ammonia Complex Observed by Matrix‐Isolation Vibrational Circular Dichroism Spectroscopy

Chirality Recognition between Neutral Molecules in the Gas Phase

Stereochemical Communication within a Chiral Ion Pair Catalyst

Chirality transfer through hydrogen-bonding: Experimental and ab initio analyses of vibrational circular dichroism spectra of methyl lactate in water

Fluorine in Pharmaceutical Industry: Fluorine-Containing Drugs Introduced to the Market in the Last Decade (2001–2011)

Unveiling the Delicate Balance of Steric and Dispersion Interactions in Organocatalysis Using High-Level Computational Methods

Aggregation-Induced Emission: Together We Shine, United We Soar!

A Robust and Accurate Tight-Binding Quantum Chemical Method for Structures, Vibrational Frequencies, and Noncovalent Interactions of Large Molecular Systems Parametrized for All spd-Block Elements (Z = 1–86)

Stereochemische Kommunikation innerhalb eines chiralen Ionenpaares

Computational Study on the Properties and Structure of Methyl Lactate

Chirality-dependent sublimation of -(trifluoromethyl)-lactic acid: Relative vapor pressures of racemic, eutectic, and enantiomerically pure forms, and vibrational spectroscopy of isolated (S,S) and (S,R) dimers

Chirality Transfer in a Methyl Lactate–Ammonia Complex Observed by Matrix‐Isolation Vibrational Circular Dichroism Spectroscopy

Chirality influence on the aggregation of methyl mandelate

Rotational isomers of lactic acid: first experimental observation of higher energy forms

Matrix isolation FTIR spectroscopic and theoretical study of methyl lactate