Studies of the molecular conformations in proteins by 2H and 13C n.m.r. spectroscopy [PDF]
, 1974 Kurt Wüthrich
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Molecular Orbital Calculations on Polypeptides and Proteins III. Conformation of Side Chains [PDF]
, 1971 G. Govil
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Conformational analysis of dipeptides in aqucous solution. II. Molecular structure of glycine and alanine dipeptides by depolarized raleigh scattering and laser Raman spectroscopy [PDF]
, 1973 M. Avignon +2 more
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Revealing the Sole Impact of Acceptor's Molecular Conformation to Energy Loss and Device Performance of Organic Solar Cells through Positional Isomers. [PDF]
Adv Sci (Weinh), 2022 Cai G +13 more
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EquiFlow: Equivariant Conditional Flow Matching with Optimal Transport for 3D Molecular Conformation Prediction [PDF]
arXivMolecular 3D conformations play a key role in determining how molecules interact with other molecules or protein surfaces. Recent deep learning advancements have improved conformation prediction, but slow training speeds and difficulties in utilizing high-degree features limit performance.
arxiv
The Molecular Structures and Conformations of Chlorocyclohexane and Bromocyclohexane as Determined by Gas-Phase Electron Diffraction. [PDF]
, 1988 Quang Shen +8 more
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The molecular conformations of 8,11-dimethyl-5,6-benzo-2-oxo-1,3,2-dioxathiepin and 4,4-dimethyl-5,6-benzo-2-oxo-1,3,2-dioxathiepin [PDF]
, 1985 A. Lachapelle, M. St-Jacques
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1H nuclear magnetic resonance and molecular orbital studies of the conformations of 3-fluoroanisole [PDF]
, 1989 Ted Schaefer, Rudy Sebastian
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Molecular Mechanics Investigation on Side-Chain Conformations of a 17α-Ethyl-17β-hydroxy Steroid with Regard to Receptor Binding [PDF]
, 1987 Martin Bohl
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