BPS2025 Full Program

709-Pos Travel Award Winner VICR: A NOVEL SOFTWARE FOR UNBIASED VIDEO AND IMAGE ANALYSIS IN SCIENTIFIC RESEARCH. Clementine A.D. Thomas , Kyle C. Kihn, Tinatin I. Brelidze EPR and NMR: Spectroscopy and Imaging (Boards B494 - B504) 710-Pos Board B494 ENHANCING ODNP STUDIES WITH AUTOMATED NMR ASSIGNMENT: A CASE STUDY WITH K-RAS. Seemal Ahmad , Warren Kincaid 711-Pos Board B495 SITE DIRECTED MUTAGENESIS, PURIFICATION, AND SITE DIRECTED SPIN LABELING OF THE HUMAN TRPV1 VOLTAGE SENSING LIKE DO MAIN. Nancy C. Rotich , Rebecca Stowe, Gary Lorigan 712-Pos Board B496 DEVELOPING A DIAGNOSTIC BLOOD TEST FOR ALS WITH ESR. Carissa Nair , Robert Dunleavy, Aritro Sinharoy, Alex L. Lai, Madhur Srivastava 713-Pos Board B497 NUCLEAR-SPIN HYPERPOLARIZATION OF BIOMOLECULES ON AN 80 MHZ BENCHTOP NMR SPECTROMETER. Sam C. Carey , Anubhab Halder, Ummay Mahfuza Shapla, Silvia Cavagnero 714-Pos Board B498 CHARACTERIZATION OF OVER-EXPRESSED THYLAKOID MEMBRANE PRO TEIN THA4 BY SITE-DIRECTED SPIN LABELING. Vidusha S. Weeesinghe , Amanda R. Storm, Carole Dabney-Smith 715-Pos Board B499 CHARACTERIZATION OF STRUCTURAL DYNAMICS OF THYLAKOID MEM BRANE TRANSPORTER PROTEIN HCF106. Nimarsha S. Kamaradiwela Arachchige , Carole Dabney-Smith 716-Pos Board B500 NMRCLUST: AUTOMATED CLASSIFICATION OF AGNOSTIC & ANTAGONIS TIC COMPOUNDS FROM 2D NMR SPECTRA. John Kevin Cava , Soumya Dutta, Sonali Mudiyanselage, Aerial M. Pratt, Wade D. Van Horn, Abhishek Singharoy 717-Pos Board B501 INCREASED SENSITIVITY AND “RULER” SYSTEMS FOR OVERHAUSER DYNAMIC NUCLEAR POLARIZATION. John M. Franck 718-Pos Board B502 ADVANCING MEMBRANE PROTEIN CONFORMATIONAL STUDIES WITH NANO-DELIVERY FOR IN-CELL DEER MEASUREMENTS. Chu Chun Cheng , Yun Wei Chiang 719-Pos Board B503 SENSITIVITY ENHANCEMENT IN BIOMOLECULAR NMR AT LOW MAG NETIC FIELD VIA LC-PHOTO-CIDNP. Anubhab Halder , Sam C. Carey, Ummay Mahfuza Shapla, Silvia Cavagnero 720-Pos Board B504 Travel Award Winner INVESTIGATING THE CONFORMATIONAL DYNAMICS OF THE HUMAN A ADENOSINE RECEPTOR IN LIPID VESICLES BY F MAS SOLID-STATE NMR. Beining Jin , Arka Prabha Ray, Matthew T. Eddy Diffraction and Scattering Techniques (Boards B505 - B508) 721-Pos Board B505 THE RENEWED GM/CA@APS STRUCTURAL BIOLOGY FACILITY AND APS UPGRADE. Nagarajan Venugopalan , Michael Becker, Stephen Corcoran, Dale Ferguson, Mark Hilgart, David J. Kissick, Oleg Makarov, Craig M. Ogata, Sergey Stepanov, Qingping Xu, Shenglan Xu, Janet L. Smith, Robert F. Fischetti Board B493

722-Pos Board B506 ATOMIC STRUCTURES OF ENZYME-BOUND LIGANDS FROM BIOSYN THETIC MIXTURES BY MICROED. Niko W. Vlahakis , Cameron W. Flowers, Mengting Liu, Matthew Agdanowski, Catherine Keyser, Joseph Loo, Yi Tang, Jose A. Rodriguez 723-Pos Board B507 LIQUID NANO-SHEET SAMPLE DELIVERY FOR FEMTOSECOND SOLUTION X-RAY SCATTERING. Adil Ansari, C. Swathi K. Menon , Patrick Konold, Roberto C. Alvarez, Dimitra Manatou, Konstantinos Karpos, Diandra Doppler, Mukul Sonker, Hao Hu, Daniel Westphal, Tej V. Yenupuri, Mar cus Herrmann, Filipe Maia, Michael F. Brown, Richard A. Kirian 724-Pos Board B508 ANTIFREEZE PROTEINS ENHANCE CELL-MEMBRANE FLUIDITY TO RE DUCE HYPOTHERMIC CELL INJURY. Yue Yang , Tatsuya Arai, Sakae Tsuda, Kazuhiro Mio, Yuji C. Sasaki Molecular Dynamics I (Boards B509 - B536) 725-Pos Board B509 DECODING THE INSULIN RECEPTOR: MECHANISMS OF BINDING AND STRUCTURAL STABILITY. Amanda D. Stange , Lorena Zuzic, Birgit Schiøtt, Nils A. Berglund 726-Pos Board B510 PREDICTING INTERACTING DOMAINS IN THE NUCLEOSOME FROM KI NETIC CORRELATIONS. Augustine C. Onyema , Chukwuebuka Dikeocha, Jonathan Moussa, Sharon M. Loverde 727-Pos Board B511 IMPROVING THE FORCE FIELD FOR LIPID INTERACTIONS WITH CALCIUM AND BERYLLIUM. Jessica Bodosa , Sergei I. Sukharev, Jeffery B. Klauda 728-Pos Board B512 ASSESSING WATER MODEL IMPACT ON PROTEIN-GLYCAN DYNAMICS: A STUDY COMBINING ALCHEMICAL FREE ENERGY AND MOLECULAR DYNAMICS APPROACHES. Deng Li, Mona Minkara 729-Pos Board B513 FREE ENERGY CALCULATIONS USING GENERATIVE MODELS TRAINED BASED ON MOLECULAR DYNAMICS TRAJECTORIES: A DIFFUSION MODEL APPROACH. Soheil Jamali , Jiahui Chen, Fauzia Haque, Mah moud Moradi 730-Pos Board B514 EFFECT OF MEMBRANE PATCH SIZE ON THE SIMULATION OF COMPLEX LIPID BILAYERS. Jinhui Li, Seth Thomson, Viviana Monje-Galvan 731-Pos Board B515 IMPLEMENTATION OF A NEW INTEGRATED ENHANCED SAMPLING METHOD WITH FAST CONVERGENCE OF FREE ENERGY CALCULATION AND LOW COMPUTATIONAL RESOURCE. Shingo Ito , Hiraku Oshima, Yuji Sugita 732-Pos Board B516 THE THERMODYNAMICS PHASES OF HIV-1 CAPSID SELF ASSEMBLY IN COARSE-GRAINED SIMULATIONS. Casey Hsu , Lorenzo Foglia, Hanyu Song, Alvin Yu 733-Pos Board B517 OMPF CHANNEL TITRATION REVISITED: PROTONATION STATES USING CONSTANT PH MOLECULAR DYNAMICS. Ernesto Tavares Neto , Marcel Aguilella-Arzo, Vicente M. Aguilella 734-Pos Board B518 LOOS: A SUITE OF SOFTWARE TO ANALYZE MOLECULAR SIMULA TIONS. Alan Grossfield , Tod D. Romo

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