Pascual-Ahuir94

J. L. Pascual-Ahuir, E. Silla, and I. Tuñón, “GEPOL: An improved description of molecular-surfaces. 3. A new algorithm for the computation of a solvent-excluding surface,” J. Comp. Chem., 15 (1994) 1127-38. DOI: 10.1002/jcc.540151009