Absolute Configuration of Bromochlorofluoromethane from Molecular Dynamics Simulation of Its Enantioselective Complexation by Cryptophane-C von Costante-Crassous, Jeanne, Marrone, Tami J, Briggs, James M, McCammon, J. Andrew, Collet, André

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Molecular Recognition of K+ and Na+ by Valinomycin in Methanol von Marrone, Tami J, Merz, Kenneth M. Jr

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Molecular recognition of potassium ion by the naturally occurring antibiotic ionophore nonactin von Marrone, Tami J, Merz, Kenneth M

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Structure-based drug design: computational advances von Marrone, T J, Briggs, J M, McCammon, J A

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Determination of Atomic Charges Including solvation and Conformational Effects von Marrone, Tami J, Hartsough, David S, Merz, Kenneth M

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Theoretical Study of Inhibition of Adenosine Deaminase by (8R)-Coformycin and (8R)-Deoxycoformycin von Marrone, Tami J, Straatsma, T. P, Briggs, James M, Wilson, David K, Quiocho, Florante A, McCammon, J. Andrew

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Solvation studies of DMP323 and A76928 bound to HIV protease: Analysis of water sites using grand canonical Monte Carlo simulations von Marrone, Tami J., McCammon, J. Andrew, Resat, Haluk, Hodge, C. Nicholas, Chang, Chong‐Hwan

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Comparison of Continuum and Explicit Models of Solvation:  Potentials of Mean Force for Alanine Dipeptide von Marrone, Tami J, Gilson, Michael K, McCammon, J. Andrew

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Enzyme-Inhibitor Association Thermodynamics von Resat, Haluk, Marrone, Tami J., McCammon, J.Andrew

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Computational Science New Horizons and Relevance to Pharmaceutical Design von Briggs, James M, Marrone, Tami J, McCammon, J.Andrew

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Pepzyme Dynamics and Conformation: A Molecular Dynamics Study in Water von Marrone, Tami J, McCammon, J. Andrew

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Transferability of ion models von Marrone, Tami J, Merz, Kenneth M

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Reply to Comment on "Transferability of Ion Models" von Marrone, Tami J, Merz, Kenneth M

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PYRIDOPYRIMIDINE KRAS INHIBITORS von VALIERE, Andrew, LAJINESS, James Paul, MCCLYMONT, Kyle Stephen, GIANATASSIO, Ryan L, MARRONE, Tami J

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Conformational sampling with Poisson-Boltzmann forces and a stochastic dynamics/Monte Carlo method: Application to alanine dipeptide von Smart, Jason L., Marrone, Tami J., McCammon, J. Andrew

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Enzyme-inhibitor association thermodynamics: explicit and continuum solvent studies von Resat, H, Marrone, T J, McCammon, J A

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QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS von MCNEILL, Matthew H, SCHLEICHER, Kristin D, HANSEN, Joshua D, LEVERSON, Joel D, NAGY, Mark A, YAN, Ming, ENGELMAN, Jeffrey A, MARRONE, Tami J, OBERG, Kevin M

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TRICYCLIC QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS von Schleicher, Kristin D, Marrone, Tami J, Engelman, Jeffrey A, Correa, Matthew D, Lajiness, James Paul, Leverson, Joel D, Valiere, Andrew, Hansen, Joshua D, Nagy, Mark A, Oberg, Kevin M, McNeill, Matthew H, Yan, Ming

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1,8-NAPHTHYRIDIN-2-ONE HETEROBIFUNCTIONAL BCL6 DEGRADERS von MCNEILL, Matthew H, SCHLEICHER, Kristin D, CORREA, Matthew D, VALIERE, Andrew, HANSEN, Joshua D, LEVERSON, Joel D, NAGY, Mark A, YAN, Ming, ENGELMAN, Jeffrey A, MARRONE, Tami J, OBERG, Kevin M

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TRICYCLIC QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS von MCNEILL, Matthew H, SCHLEICHER, Kristin D, CORREA, Matthew D, VALIERE, Andrew, HANSEN, Joshua D, LAJINESS, James Paul, LEVERSON, Joel D, NAGY, Mark A, YAN, Ming, ENGELMAN, Jeffrey A, MARRONE, Tami J, OBERG, Kevin M

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