Training Neural Nets To Learn Reactive Potential Energy Surfaces Using Interactive Quantum Chemistry in Virtual Reality von Amabilino, Silvia, Bratholm, Lars A, Bennie, Simon J, Vaucher, Alain C, Reiher, Markus, Glowacki, David R

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Low dimensional representations along intrinsic reaction coordinates and molecular dynamics trajectories using interatomic distance matrices von Hare, Stephanie R, Bratholm, Lars A, Glowacki, David R, Carpenter, Barry K

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Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality von Bennie, Simon J, Ranaghan, Kara E, Deeks, Helen, Goldsmith, Heather E, O’Connor, Michael B, Mulholland, Adrian J, Glowacki, David R

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Interactive molecular dynamics in virtual reality from quantum chemistry to drug binding: An open-source multi-person framework von O’Connor, Michael B., Bennie, Simon J., Deeks, Helen M., Jamieson-Binnie, Alexander, Jones, Alex J., Shannon, Robin J., Walters, Rebecca, Mitchell, Thomas J., Mulholland, Adrian J., Glowacki, David R.

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Interactive molecular dynamics in virtual reality for accurate flexible protein-ligand docking von Deeks, Helen M., Walters, Rebecca K., Hare, Stephanie R., O'Connor, Michael B., Mulholland, Adrian J., Glowacki, David R.

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Sampling molecular conformations and dynamics in a multiuser virtual reality framework von O'Connor, Michael, Deeks, Helen M, Dawn, Edward, Metatla, Oussama, Roudaut, Anne, Sutton, Matthew, Thomas, Lisa May, Glowacki, Becca Rose, Sage, Rebecca, Tew, Philip, Wonnacott, Mark, Bates, Phil, Mulholland, Adrian J, Glowacki, David R

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Group VR experiences can produce ego attenuation and connectedness comparable to psychedelics von Glowacki, David R., Williams, Rhoslyn Roebuck, Wonnacott, Mark D., Maynard, Olivia M., Freire, Rachel, Pike, James E., Chatziapostolou, Mike

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Evidence-Based Adjustments to Cognitive Processing Therapy to Reduce Dropout von Glowacki, Christopher R., Glowacki, Zachary R.

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Unraveling the role of protein dynamics in dihydrofolate reductase catalysis von Luk, Louis Y. P., Ruiz-Pernía, J. Javier, Dawson, William M., Roca, Maite, Loveridge, E. Joel, Glowacki, David R., Harvey, Jeremy N., Mulholland, Adrian J., Tuñón, Iñaki, Moliner, Vicent, Allemann, Rudolf K.

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Free energy along drug-protein binding pathways interactively sampled in virtual reality von Deeks, Helen M., Zinovjev, Kirill, Barnoud, Jonathan, Mulholland, Adrian J., van der Kamp, Marc W., Glowacki, David R.

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Urinary excretion of homocysteine thiolactone and the risk of acute myocardial infarction in coronary artery disease patients: the WENBIT trial von Borowczyk, K., Piechocka, J., Głowacki, R., Dhar, I., Midtun, Ø., Tell, G. S., Ueland, P. M., Nygård, O., Jakubowski, H.

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Theoretical Chemical Kinetics in Tropospheric Chemistry: Methodologies and Applications von Vereecken, Luc, Glowacki, David R, Pilling, Michael J

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Perceptions at the nanoscale von Glowacki, David R.

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A simple HPLC—UV method for simultaneous determination of cysteine and cysteinylglycine in biological fluids von Głowacki, R., Stachniuk, J., Borowczyk, K.

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Aldosterone Modulates Blood Homocysteine and Cholesterol in Coronary Artery Disease Patients – a Possible Impact on Atherothrombosis? von KAROLCZAK, K., KUBALCZYK, P., GLOWACKI, R., PIETRUSZYNSKI, R., WATALA, C.

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Vibrational relaxation and microsolvation of DF after F-atom reactions in polar solvents von Dunning, G. T., Glowacki, D. R., Preston, T. J., Greaves, S. J., Greetham, G. M., Clark, I. P., Towrie, M., Harvey, J. N., Orr-Ewing, A. J.

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Taking Ockham's razor to enzyme dynamics and catalysis von Glowacki, David R., Harvey, Jeremy N., Mulholland, Adrian J.

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IMPRESSION - prediction of NMR parameters for 3-dimensional chemical structures using machine learning with near quantum chemical accuracy von Gerrard, Will, Bratholm, Lars A, Packer, Martin J, Mulholland, Adrian J, Glowacki, David R, Butts, Craig P

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Multiscale analysis of enantioselectivity in enzyme-catalysed ‘lethal synthesis’ using projector-based embedding von Zhang, Xinglong, Bennie, Simon J., van der Kamp, Marc W., Glowacki, David R., Manby, Frederick R., Mulholland, Adrian J.

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Analysis of plasma thiols by high-performance liquid chromatography with ultraviolet detection von Bald, E., Chwatko, G., Głowacki, R., Kuśmierek, K.

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