Computer simulation of the binding of quinocarcin to DNA. Prediction of mode of action and absolute configuration

Ground states of molecules. 38. The MNDO method. Approximations and parameters

Michael J. S. Dewar, Walter Thiel · Journal of the American Chemical Society · 1977 · 5.1K citations

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A new force field for molecular mechanical simulation of nucleic acids and proteins

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<scp>AMBER</scp>: Assisted model building with energy refinement. A general program for modeling molecules and their interactions

Paul K. Weiner, Peter A. Kollman · Journal of Computational Chemistry · 1981 · 1.2K citations

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A handbook of computational chemistry

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Reaction of the antitumor antibiotic CC-1065 with DNA. Location of the site of thermally induced strand breakage and analysis of DNA sequence specificity

Vincent L. Reynolds, Ian J. Molineux, David Kaplan et al. · Biochemistry · 1985 · 203 citations

Pharmacy, Molecular Biology, Chemotherapy +9