Synthesis and characterization of energetic molecules based on pyrimidine rings: Selection and verification of computational-assisted synthesis pathways

Multiwfn: A multifunctional wavefunction analyzer

Tian Lu, Feiwu Chen · Journal of Computational Chemistry · 2011 · 43K citations

Natural Sciences, Chemistry, Visualization +15

Revealing Noncovalent Interactions

Erin R. Johnson, Shahar Keinan, Paula Mori‐Sánchez et al. · Journal of the American Chemical Society · 2010 · 9.3K citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

Hirshfeld surface analysis

Mark A. Spackman, Dylan Jayatilaka · CrystEngComm · 2008 · 7.8K citations

Natural Sciences, Chemistry, Computational Chemistry +12

Independent gradient model based on Hirshfeld partition: A new method for visual study of interactions in chemical systems

Tian Lu, Qinxue Chen · Journal of Computational Chemistry · 2022 · 3.5K citations

Natural Sciences, Chemistry, Visualization +14

Quantitative analysis of molecular surface based on improved Marching Tetrahedra algorithm

Tian Lu, Feiwu Chen · Journal of Molecular Graphics and Modelling · 2012 · 2.7K citations

Natural Sciences, Chemistry, Computer Science +16