Quantitative analysis of molecular surfaces: areas, volumes, electrostatic potentials and average local ionization energies
Felipe A. BulatFable Theory & Computation LLC, PO Box 21811, Washington, DC 20009, USA. [email protected]Alejandro Toro‐LabbéLaboratorio de Química Teórica Computacional (QTC), Facultad de Química, Pontificia Universidad Católica de Chile, Vicuña Mackenna 4860, Macul, Santiago, ChileTore BrinckPhysical Chemistry, School of Chemical Science and Engineering, Royal Institute of Technology (KTH), SE-100 44, Stockholm, SwedenJane S. MurrayCleveTheoComp, 1951 W. 26th Street, Cleveland, OH, 44113, USAPeter PolitzerCleveTheoComp, 1951 W. 26th Street, Cleveland, OH, 44113, USA
2010en
ABI
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