Rapid parameterization of small molecules using the force field toolkit von Mayne, Christopher G., Saam, Jan, Schulten, Klaus, Tajkhorshid, Emad, Gumbart, James C.

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Structural underpinnings of oestrogen receptor mutations in endocrine therapy resistance von Katzenellenbogen, John A., Mayne, Christopher G., Katzenellenbogen, Benita S., Greene, Geoffrey L., Chandarlapaty, Sarat

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Adaptive Multilevel Splitting Method for Molecular Dynamics Calculation of Benzamidine-Trypsin Dissociation Time von Teo, Ivan, Mayne, Christopher G, Schulten, Klaus, Lelièvre, Tony

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Induced and natural regulatory T cells in the development of inflammatory bowel disease von Mayne, Christopher G, Williams, Calvin B

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Assembly and Analysis of Cell-Scale Membrane Envelopes von Vermaas, Josh V, Mayne, Christopher G, Shinn, Eric, Tajkhorshid, Emad

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All-Atom Molecular Dynamics of Virus Capsids as Drug Targets von Perilla, Juan R, Hadden, Jodi A, Goh, Boon Chong, Mayne, Christopher G, Schulten, Klaus

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Estrogen receptor alpha somatic mutations Y537S and D538G confer breast cancer endocrine resistance by stabilizing the activating function-2 binding conformation von Fanning, Sean W, Mayne, Christopher G, Dharmarajan, Venkatasubramanian, Carlson, Kathryn E, Martin, Teresa A, Novick, Scott J, Toy, Weiyi, Green, Bradley, Panchamukhi, Srinivas, Katzenellenbogen, Benita S, Tajkhorshid, Emad, Griffin, Patrick R, Shen, Yang, Chandarlapaty, Sarat, Katzenellenbogen, John A, Greene, Geoffrey L

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Crystal structure of the SALL4–pomalidomide–cereblon–DDB1 complex von Matyskiela, Mary E., Clayton, Thomas, Zheng, Xinde, Mayne, Christopher, Tran, Eileen, Carpenter, Aaron, Pagarigan, Barbra, McDonald, Joseph, Rolfe, Mark, Hamann, Lawrence G., Lu, Gang, Chamberlain, Philip P.

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A membrane-embedded pathway delivers general anesthetics to two interacting binding sites in the Gloeobacter violaceus ion channel von Arcario, Mark J., Mayne, Christopher G., Tajkhorshid, Emad

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The Role of Micronutrients in Graft-VS.-Host Disease: Immunomodulatory Effects of Vitamins A and D von Chen, Xiao, Mayne, Christopher G

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Flexibility Coexists with Shape-Persistence in Cyanostar Macrocycles von Liu, Yun, Singharoy, Abhishek, Mayne, Christopher G, Sengupta, Arkajyoti, Raghavachari, Krishnan, Schulten, Klaus, Flood, Amar H

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Stapled Peptides with [gamma]-Methylated Hydrocarbon Chains for the Estrogen Receptor/Coactivator Interaction von Speltz, Thomas E, Fanning, Sean W, Mayne, Christopher G, Fowler, Colin, Tajkhorshid, Emad, Greene, Geoffrey L, Moore, Terry W

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Stapled Peptides with γ-Methylated Hydrocarbon Chains for the Estrogen Receptor/Coactivator Interaction von Speltz, Thomas E., Fanning, Sean W., Mayne, Christopher G., Fowler, Colin, Tajkhorshid, Emad, Greene, Geoffrey L., Moore, Terry W.

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The SERM/SERD bazedoxifene disrupts ESR1 helix 12 to overcome acquired hormone resistance in breast cancer cells von Fanning, Sean W, Jeselsohn, Rinath, Dharmarajan, Venkatasubramanian, Mayne, Christopher G, Karimi, Mostafa, Buchwalter, Gilles, Houtman, René, Toy, Weiyi, Fowler, Colin E, Han, Ross, Lainé, Muriel, Carlson, Kathryn E, Martin, Teresa A, Nowak, Jason, Nwachukwu, Jerome C, Hosfield, David J, Chandarlapaty, Sarat, Tajkhorshid, Emad, Nettles, Kendall W, Griffin, Patrick R, Shen, Yang, Katzenellenbogen, John A, Brown, Myles, Greene, Geoffrey L

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Minireview: Not Picking Pockets: Nuclear Receptor Alternate-Site Modulators (NRAMs) von Moore, Terry W, Mayne, Christopher G, Katzenellenbogen, John A

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Atomistic Models of General Anesthetics for Use in in Silico Biological Studies von Arcario, Mark J, Mayne, Christopher G, Tajkhorshid, Emad

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Design of pathway preferential estrogens that provide beneficial metabolic and vascular effects without stimulating reproductive tissues von Madak-Erdogan, Zeynep, Kim, Sung Hoon, Gong, Ping, Zhao, Yiru C, Zhang, Hui, Chambliss, Ken L, Carlson, Kathryn E, Mayne, Christopher G, Shaul, Philip W, Korach, Kenneth S, Katzenellenbogen, John A, Katzenellenbogen, Benita S

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1,25-Dihydroxyvitamin D₃ acts directly on the T lymphocyte vitamin D receptor to inhibit experimental autoimmune encephalomyelitis von Mayne, Christopher G, Spanier, Justin A, Relland, Lance M, Williams, Calvin B, Hayes, Colleen E

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Preparation of o‑Fluorophenols from Nonaromatic Precursors: Mechanistic Considerations for Adaptation to Fluorine-18 Radiolabeling von Yasui, Norio, Mayne, Christopher G, Katzenellenbogen, John A

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Vitamin D and estrogen synergy in Vdr -expressing CD4+ T cells is essential to induce Helios+ FoxP3+ T cells and prevent autoimmune demyelinating disease von Spanier, Justin A, Nashold, Faye E, Mayne, Christopher G, Nelson, Corwin D, Hayes, Colleen E

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