Robustness in the fitting of molecular mechanics parameters.
about
Open source molecular modelingCHARMM Drude Polarizable Force Field for Aldopentofuranoses and Methyl-aldopentofuranosides.Development of a glycoconjugate vaccine to prevent invasive Salmonella Typhimurium infections in sub-Saharan Africa.Further along the Road Less Traveled: AMBER ff15ipq, an Original Protein Force Field Built on a Self-Consistent Physical ModelDrude polarizable force field for aliphatic ketones and aldehydes, and their associated acyclic carbohydrates.Revised RNA Dihedral Parameters for the Amber Force Field Improve RNA Molecular Dynamics.Additive CHARMM force field for naturally occurring modified ribonucleotides.Conformational Preference of Serogroup B Salmonella O Polysaccharide in Presence and Absence of the Monoclonal Antibody Se155-4.Parametrization of macrolide antibiotics using the force field toolkit.POVME 3.0: Software for Mapping Binding Pocket Flexibility.Induced polarization restricts the conformational distribution of a light-harvesting molecular triad in the ground state.Development of CHARMM-Compatible Force-Field Parameters for Cobalamin and Related Cofactors from Quantum Mechanical Calculations.Proper balance of solvent-solute and solute-solute interactions in the treatment of the diffusion of glucose using the Drude polarizable force field.Developing accurate molecular mechanics force fields for conjugated molecular systems.CHARMM Drude Polarizable Force Field for Glycosidic Linkages Involving Pyranoses and Furanoses.
P2860
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P2860
Robustness in the fitting of molecular mechanics parameters.
description
2015 nî lūn-bûn
@nan
2015年の論文
@ja
2015年論文
@yue
2015年論文
@zh-hant
2015年論文
@zh-hk
2015年論文
@zh-mo
2015年論文
@zh-tw
2015年论文
@wuu
2015年论文
@zh
2015年论文
@zh-cn
name
Robustness in the fitting of molecular mechanics parameters.
@en
type
label
Robustness in the fitting of molecular mechanics parameters.
@en
prefLabel
Robustness in the fitting of molecular mechanics parameters.
@en
P2860
P356
P1476
Robustness in the fitting of molecular mechanics parameters
@en
P2093
Mingjun Yang
P2860
P304
P356
10.1002/JCC.23897
P577
2015-03-31T00:00:00Z