Applications of free energy calculations to chemistry and biology

C. Chipot (1) , A.E. Mark (2) , V.S. Pande (3) , T. Simonson (4)

1 SRSMC - Structure et Réactivité des Systèmes Moléculaires Complexes
2 Institute for Molecular Bioscience
3 Departments of Chemistry and of Structural Biology
4 BIOC - Laboratoire de Biochimie de l'Ecole polytechnique

Domains: Life Sciences [q-bio]; Biochemistry, Molecular Biology

C. Chipot, A.E. Mark, V.S. Pande, T. Simonson. Applications of free energy calculations to chemistry and biology. Christophe Chipot, Andrew Pohorille. Free Energy Calculations, 86 (N/A), Springer, pp.463-501, 2007, Springer Series in CHEMICAL PHYSICS, vol. 86, 978-3-540-38447-2. ⟨10.1007/978-3-540-38448-9_13⟩. ⟨hal-00767091⟩