Pages that link to "Q29543705"
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The following pages link to An efficient newton-like method for molecular mechanics energy minimization of large molecules (Q29543705):
Displaying 50 items.
- Coarse-grained modeling of RNA 3D structure (Q26749123) (← links)
- Structural and Mechanistic Studies on Klebsiella pneumoniae 2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline Decarboxylase (Q27664385) (← links)
- HMP Binding Protein ThiY and HMP-P Synthase THI5 Are Structural Homologues, (Q27664682) (← links)
- Characterization of the Structure and Function of Klebsiella pneumoniae Allantoin Racemase (Q27668041) (← links)
- Structural and kinetic insights into the mechanism of 5-hydroxyisourate hydrolase fromKlebsiella pneumoniae (Q27671087) (← links)
- Structural basis of intersubunit recognition in elongin BC-cullin 5-SOCS box ubiquitin-protein ligase complexes (Q27685307) (← links)
- Probabilistic validation of protein NMR chemical shift assignments (Q28601207) (← links)
- Close agreement between the orientation dependence of hydrogen bonds observed in protein structures and quantum mechanical calculations (Q28914752) (← links)
- Molecular modelling in structural biology. (Q30329498) (← links)
- Analysis of anisotropic side-chain packing in proteins and application to high-resolution structure prediction. (Q30342766) (← links)
- Detecting local residue environment similarity for recognizing near-native structure models. (Q30365803) (← links)
- CONFOLD: Residue-residue contact-guided ab initio protein folding. (Q30374675) (← links)
- ProCS15: a DFT-based chemical shift predictor for backbone and Cβ atoms in proteins. (Q30382087) (← links)
- Protein structure refinement using a quantum mechanics-based chemical shielding predictor (Q30401462) (← links)
- Self-organization of nano-lines and dots triggered by a local mechanical stimulus (Q30478453) (← links)
- Aborted double bicycle-pedal isomerization with hydrogen bond breaking is the primary event of bacteriorhodopsin proton pumping (Q30497552) (← links)
- Peripheral ligand-binding site in cytochrome P450 3A4 located with fluorescence resonance energy transfer (FRET) (Q30511797) (← links)
- Absolute comparison of simulated and experimental protein-folding dynamics (Q30868882) (← links)
- First-principles data set of 45,892 isolated and cation-coordinated conformers of 20 proteinogenic amino acids (Q31046295) (← links)
- Quantum chemical modeling of rhodopsin mutants displaying switchable colors (Q31064541) (← links)
- The phosphorylation site in double helical amylopectin as investigated by a combined approach using chemical synthesis, crystallography and molecular modeling (Q31139837) (← links)
- A potent integrin antagonist from a small library of cyclic RGD pentapeptide mimics including benzyl-substituted azabicycloalkane amino acids (Q33366637) (← links)
- Structure, initial excited-state relaxation, and energy storage of rhodopsin resolved at the multiconfigurational perturbation theory level (Q33581748) (← links)
- Integrative structure modeling of macromolecular assemblies from proteomics data (Q33589651) (← links)
- Intrinsically disordered regions may lower the hydration free energy in proteins: a case study of nudix hydrolase in the bacterium Deinococcus radiodurans (Q33640094) (← links)
- Free-energy function for discriminating the native fold of a protein from misfolded decoys (Q33894160) (← links)
- Supramolecular self-assembled fullerene nanostructures (Q34023383) (← links)
- Laser pulse trains for controlling excited state dynamics of adenine in water (Q34151515) (← links)
- Investigation of the complexation of (+)-catechin by beta-cyclodextrin by a combination of NMR, microcalorimetry and molecular modeling techniques (Q34227988) (← links)
- Nonlinear absorption dynamics using field-induced surface hopping: zinc porphyrin in water. (Q34669902) (← links)
- Modeling DNA structures (Q35420446) (← links)
- Mechanism of the myosin catalyzed hydrolysis of ATP as rationalized by molecular modeling (Q35758716) (← links)
- MDTraj: A Modern Open Library for the Analysis of Molecular Dynamics Trajectories. (Q35816082) (← links)
- Approaching rational epitope vaccine design for hepatitis C virus with meta-server and multivalent scaffolding (Q35942829) (← links)
- Expanding DP4: application to drug compounds and automation. (Q35979790) (← links)
- A Folding Pathway Model of Mini-Protein BBA5 (Q36118923) (← links)
- EpiSweep: Computationally Driven Reengineering of Therapeutic Proteins to Reduce Immunogenicity While Maintaining Function (Q36212517) (← links)
- Molecular bases for the selection of the chromophore of animal rhodopsins (Q36394365) (← links)
- Comparison of free energy methods for molecular systems (Q36658081) (← links)
- Dynamic folding pathway models of the Trp-cage protein (Q36999561) (← links)
- Transition pathway and its free-energy profile: a protocol for protein folding simulations (Q37139122) (← links)
- Biomolecular simulation and modelling: status, progress and prospects (Q37210701) (← links)
- Trp zipper folding kinetics by molecular dynamics and temperature-jump spectroscopy. (Q37356463) (← links)
- Trends for isolated amino acids and dipeptides: Conformation, divalent ion binding, and remarkable similarity of binding to calcium and lead (Q37390662) (← links)
- Genome-scale characterization of RNA tertiary structures and their functional impact by RNA solvent accessibility prediction (Q37507905) (← links)
- Welcoming natural isotopic abundance in solid-state NMR: probing π-stacking and supramolecular structure of organic nanoassemblies using DNP. (Q37705205) (← links)
- Genome-wide inference of transcription factor-DNA binding specificity in cell regeneration using a combination strategy (Q38322965) (← links)
- MMM - A toolbox for integrative structure modelling. (Q38629275) (← links)
- Araiosamines A−D: Tris-bromoindole Cyclic Guanidine Alkaloids from the Marine Sponge Clathria (Thalysias) araiosa (Q38643716) (← links)
- Trends of intramolecular hydrogen bonding in substituted alcohols: a deeper investigation (Q38719367) (← links)