Christopher G Mayne
Title
Cited by
Cited by
Year
Rapid parameterization of small molecules using the force field toolkit
CG Mayne, J Saam, K Schulten, E Tajkhorshid, JC Gumbart
Journal of computational chemistry 34 (32), 2757-2770, 2013
3852013
Estrogen receptor alpha somatic mutations Y537S and D538G confer breast cancer endocrine resistance by stabilizing the activating function-2 binding conformation
SW Fanning, CG Mayne, V Dharmarajan, KE Carlson, TA Martin, ...
Elife 5, e12792, 2016
1552016
Minireview: Not picking pockets: nuclear receptor alternate-site modulators (NRAMs)
TW Moore, CG Mayne, JA Katzenellenbogen
Molecular Endocrinology 24 (4), 683-695, 2010
1242010
Structural underpinnings of oestrogen receptor mutations in endocrine therapy resistance
JA Katzenellenbogen, CG Mayne, BS Katzenellenbogen, GL Greene, ...
Nature Reviews Cancer, 1, 2018
762018
Adaptive multilevel splitting method for molecular dynamics calculation of benzamidine-trypsin dissociation time
I Teo, CG Mayne, K Schulten, T Lelièvre
Journal of chemical theory and computation 12 (6), 2983-2989, 2016
752016
Stapled Peptides with γ‐Methylated Hydrocarbon Chains for the Estrogen Receptor/Coactivator Interaction
TE Speltz, SW Fanning, CG Mayne, C Fowler, E Tajkhorshid, GL Greene, ...
Angewandte Chemie International Edition 55 (13), 4252-4255, 2016
652016
All-atom molecular dynamics of virus capsids as drug targets
JR Perilla, JA Hadden, BC Goh, CG Mayne, K Schulten
The journal of physical chemistry letters 7 (10), 1836-1844, 2016
642016
Design of pathway preferential estrogens that provide beneficial metabolic and vascular effects without stimulating reproductive tissues
Z Madak-Erdogan, SH Kim, P Gong, YC Zhao, H Zhang, KL Chambliss, ...
Sci. Signal. 9 (429), ra53-ra53, 2016
542016
Imaging progesterone receptor in breast tumors: synthesis and receptor binding affinity of fluoroalkyl-substituted analogues of tanaproget
HB Zhou, JH Lee, CG Mayne, KE Carlson, JA Katzenellenbogen
Journal of medicinal chemistry 53 (8), 3349-3360, 2010
502010
Flexibility Coexists with Shape-Persistence in Cyanostar Macrocycles
Y Liu, A Singharoy, CG Mayne, A Sengupta, K Raghavachari, K Schulten, ...
Journal of the American Chemical Society 138 (14), 4843-4851, 2016
402016
The SERM/SERD bazedoxifene disrupts ESR1 helix 12 to overcome acquired hormone resistance in breast cancer cells
SW Fanning, R Jeselsohn, V Dharmarajan, CG Mayne, M Karimi, ...
eLife 7, e37161, 2018
372018
The cellular membrane as a mediator for small molecule interaction with membrane proteins
CG Mayne, MJ Arcario, P Mahinthichaichan, JL Baylon, JV Vermaas, ...
Biochimica et Biophysica Acta (BBA)-Biomembranes 1858 (10), 2290-2304, 2016
322016
Macromolecular Crystallography for Synthetic Abiological Molecules: Combining xMDFF and PHENIX for Structure Determination of Cyanostar Macrocycles
A Singharoy, B Venkatakrishnan, Y Liu, CG Mayne, S Lee, CH Chen, ...
Journal of the American Chemical Society 137 (27), 8810-8818, 2015
312015
Atomistic models of general anesthetics for use in in silico biological studies
MJ Arcario, CG Mayne, E Tajkhorshid
The Journal of Physical Chemistry B 118 (42), 12075-12086, 2014
282014
Adamantyl antiestrogens with novel side chains reveal a spectrum of activities in suppressing estrogen receptor mediated activities in breast cancer cells
J Min, VS Guillen, A Sharma, Y Zhao, Y Ziegler, P Gong, CG Mayne, ...
Journal of medicinal chemistry 60 (14), 6321-6336, 2017
232017
Neural-Network Scoring Functions Identify Structurally Novel Estrogen-Receptor Ligands
JD Durrant, KE Carlson, TA Martin, TL Offutt, CG Mayne, ...
Journal of chemical information and modeling 55 (9), 1953-1961, 2015
232015
A "Cross-Stitched" Peptide with Improved Helicity and Proteolytic Stability
TE Speltz, CG Mayne, SW Fanning, Z Siddiqui, E Tajkhorshid, GL Greene, ...
Organic & Biomolecular Chemistry, in press, 2018
172018
Preparation of o-Fluorophenols from Nonaromatic Precursors: Mechanistic Considerations for Adaptation to Fluorine-18 Radiolabeling
N Yasui, CG Mayne, JA Katzenellenbogen
Organic letters 17 (22), 5540-5543, 2015
172015
Adaptive Multilevel Splitting in Molecular Dynamics Simulations
D Aristoff, T Lelièvre, CG Mayne, I Teo
ESAIM: Proceedings and Surveys 48, 215-225, 2015
172015
A membrane-embedded pathway delivers general anesthetics to two interacting binding sites in the Gloeobacter violaceus ion channel
MJ Arcario, CG Mayne, E Tajkhorshid
Journal of Biological Chemistry 292 (23), 9480-9492, 2017
162017
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Articles 1–20