glycowork 0.6.0

Package for processing and analyzing glycans

Glycowork

Glycans are a fundamental biological sequence, similar to DNA, RNA, or proteins. Glycans are complex carbohydrates that can form branched structures comprising monosaccharides and linkages as constituents. Despite being conspicuously absent from most research, glycans are ubiquitous in biology. They decorate most proteins and lipids and direct the stability and functions of biomolecules, cells, and organisms. This also makes glycans relevant to every human disease.

The analysis of glycans is made difficult by their nonlinearity and their astounding diversity, given the large number of monosaccharides and types of linkages. Glycowork is a Python package designed to process and analyze glycan sequences, with a special emphasis on glycan-focused data science and machine learning. Next to various functions to work with glycans, glycowork also contains glycan data that can be used for model training, motif comparisons, etc. Glycowork uses human-readable IUPAC-condensed (e.g., Neu5Ac(a2-3)Gal(b1-3)[Neu5Ac(a2-6)]GalNAc) as a user-facing string representation and monosaccharide-level graphs as a powerful behind-the-scenes architecture.

If you use glycowork or any of our datasets in your project, please cite Thomes et al., 2021.

The inspiration for glycowork can be found in Bojar et al., 2020 and Burkholz et al., 2021. There, you can also find examples of possible use cases for the functions in glycowork.

The full documentation for glycowork can be found here: https://bojarlab.github.io/glycowork/

If you want to contribute to glycowork, the best place to start is to read our contribution guidelines.

Install

via pip:
pip install glycowork
import glycowork

alternative:
pip install git+https://github.com/BojarLab/glycowork.git
import glycowork

Data & Models

Glycowork currently contains the following main datasets that are freely available to everyone:

• df_glycan
  • contains >51,500 unique glycan sequences, including labels such as >33,000 species associations, >9,500 tissue associations, and >500 disease associations
• glycan_binding
  • contains >550,000 protein-glycan binding interactions, from 1,392 unique glycan-binding proteins

Additionally, we store these trained deep learning models for easy usage, which can be retrieved with the prep_model function:

• LectinOracle
  • can be used to predict glycan-binding specificity of a protein, given its ESM-1b representation; from Lundstrom et al., 2021
• LectinOracle_flex
  • operates the same as LectinOracle but can directly use the raw protein sequence as input (no ESM-1b representation required)
• SweetNet
  • a graph convolutional neural network trained to predict species from glycan, can be used to generate learned glycan representations; from Burkholz et al., 2021
• NSequonPred
  • given the ESM-1b representation of an N-sequon (+/- 20 AA), this model can predict whether the sequon will be glycosylated

How to use

Glycowork currently contains four main modules:

• glycan_data
  • stores several glycan datasets and contains helper functions
• ml
  • here are all the functions for training and using machine learning models, including train-test-split, getting glycan representations, etc.
• motif
  • contains functions for processing glycan sequences, identifying motifs and features, and analyzing them
• network
  • contains functions for constructing and analyzing glycan networks (e.g., biosynthetic networks)

Below are some examples of what you can do with glycowork; be sure to check out the other examples in the full documentation for everything that’s there. A non-exhaustive list includes:

• using trained AI models for prediction
• training your own AI models
• motif enrichment analyses
• annotating motifs in glycans
• finding out whether & where glycans are describing the same sequence
• m/z to composition to structure to motif mappings
• mass calculation
• visualizing motif distribution / glycan similarities / sequence properties
• constructing and analyzing biosynthetic networks

#get motifs, graph features, and sequence features of a set of glycan sequences to train models or analyze glycan properties
glycans = ['Man(a1-3)[Man(a1-6)][Xyl(b1-2)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-3)]GlcNAc',
           'Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-3)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc',
           'GalNAc(a1-4)GlcNAcA(a1-4)[GlcN(b1-7)]Kdo(a2-5)[Kdo(a2-4)]Kdo(a2-6)GlcN4P(b1-6)GlcN1P']
from glycowork.motif.annotate import annotate_dataset
out = annotate_dataset(glycans, feature_set = ['known', 'graph', 'exhaustive']).head()

	LewisX	LewisY	SialylLewisX	SulfoSialylLewisX	LewisA	LewisB	SialylLewisA	SulfoLewisA	H_type2	H_type1	A_antigen	B_antigen	Galili_antigen	GloboH	Gb5	Gb4	Gb3	3SGb3	8DSGb3	3SGb4	8DSGb4	6DSGb4	3SGb5	8DSGb5	6DSGb5	6DSGb5_2	6SGb3	8DSGb3_2	6SGb4	8DSGb4_2	6SGb5	8DSGb5_2	66DSGb5	Forssman_antigen	iGb3	I_antigen	i_antigen	PI_antigen	Chitobiose	Trimannosylcore	Internal_LacNAc_type1	Terminal_LacNAc_type1	Internal_LacNAc_type2	Terminal_LacNAc_type2	Internal_LacdiNAc_type1	Terminal_LacdiNAc_type1	Internal_LacdiNAc_type2	Terminal_LacdiNAc_type2	bisectingGlcNAc	VIM	PolyLacNAc	Ganglio_Series	Lacto_Series(LewisC)	NeoLacto_Series	betaGlucan	KeratanSulfate	Hyluronan	Mollu_series	Arthro_series	Cellulose_like	Chondroitin_4S	GPI_anchor	Isoglobo_series	LewisD	Globo_series	Sda	SDA	Muco_series	Heparin	Peptidoglycan	Dermatansulfate	CAD	Lactosylceramide	Lactotriaosylceramide	LexLex	GM3	H_type3	GM2	GM1	cisGM1	VIM2	GD3	GD1a	GD2	GD1b	SDLex	Nglycolyl_GM2	Fuc_LN3	GT1b	GD1	GD1a_2	LcGg4	GT3	Disialyl_T_antigen	GT1a	GT2	GT1c	2Fuc_GM1	GQ1c	O_linked_mannose	GT1aa	GQ1b	HNK1	GQ1ba	O_mannose_Lex	2Fuc_GD1b	Sialopentaosylceramide	Sulfogangliotetraosylceramide	B-GM1	GQ1aa	bisSulfo-Lewis x	para-Forssman	core_fucose	core_fucose(a1-3)	GP1c	B-GD1b	GP1ca	Isoglobotetraosylceramide	polySia	high_mannose	Gala_series	LPS_core	Nglycan_complex	Nglycan_complex2	Oglycan_core2	Oglycan_core3	Oglycan_core4	Oglycan_core5	Oglycan_core6	Oglycan_core7	Xylogalacturonan	Sialosylparagloboside	LDNF	OFuc	Arabinogalactan_type2	EGF_repeat	Nglycan_hybrid	Arabinan	Xyloglucan	Acharan_Sulfate	M3FX	M3X	1-6betaGalactan	Arabinogalactan_type1	Galactomannan	Tetraantennary_Nglycan	Mucin_elongated_core2	Fucoidan	Alginate	FG	XX	Difucosylated_core	GalFuc_core	diameter	branching	nbrLeaves	avgDeg	varDeg	maxDeg	nbrDeg4	max_deg_leaves	mean_deg_leaves	deg_assort	betweeness	betwVar	betwMax	eigenMax	eigenMin	eigenAvg	eigenVar	closeMax	closeMin	closeAvg	closeVar	flowMax	flowAvg	flowVar	flow_edgeMax	flow_edgeMin	flow_edgeAvg	flow_edgeVar	loadMax	loadAvg	loadVar	harmMax	harmMin	harmAvg	harmVar	secorderMax	secorderMin	secorderAvg	secorderVar	size_corona	size_core	nbr_node_types	egap	entropyStation	N	dens	0dHex	1,4-Anhydro-Gal-ol	1,5-Anhydro-D-AltNAc-ol	1,5-Anhydro-D-FucN-ol	1,5-Anhydro-D-Rha4NAc-ol	1,5-Anhydro-Gal-ol	1,5-Anhydro-GalNAc-ol	1,5-Anhydro-Glc-ol	1,5-Anhydro-Glc-onic	1,5-Anhydro-GlcN2S-ol	1,5-Anhydro-GlcN2S6S-ol	1,5-Anhydro-GlcNAc-ol	1,5-Anhydro-GlcNAc-onic	1,5-Anhydro-Man-ol	1,5-Anhydro-ManNAc-ol	1,5-Anhydro-Xyl-ol	1,5-Anhydro-Xyl2F-ol	1-1	1-2	1-3	1-4	1-5	1-6	1-?	1dAlt-ol	1dEry-ol	2,3-Anhydro-All	2,3-Anhydro-Man	2,3-Anhydro-Rib	2,5-Anhydro-D-Alt-ol	2,5-Anhydro-D-Alt3S-ol	2,5-Anhydro-D-Tal	2,5-Anhydro-Glc	2,5-Anhydro-L-Man-ol	2,5-Anhydro-Man	2,5-Anhydro-Man-ol	2,5-Anhydro-Man1S-ol	2,5-Anhydro-Man3S-ol	2,5-Anhydro-Man6S	2,5-Anhydro-Tal-ol	2,5-Anhydro-Tal6P	2,6-Anhydro-Glc5NAc-ol	2,6-Anhydro-L-Gul-ol	2,6-Anhydro-L-Gul-onic	2,6-Anhydro-Man-ol	2,6-Anhydro-Tal5NAc-ol	2,7-Anhydro-Kdo	2,7-Anhydro-Kdof	2-3	2-4	2-5	2-6	3,6-Anhydro-Fruf	3,6-Anhydro-Gal	3,6-Anhydro-Gal2S	3,6-Anhydro-Glc	3,6-Anhydro-L-Gal	3,6-Anhydro-L-Gal2Me	3-1	3-5	3-Anhydro-Gal	3-Anhydro-Gal2S	3dFuc	3dGal	3dLyxHep-ulosaric	4,7-Anhydro-Kdo	4,7-Anhydro-KdoOPEtN	4,8-Anhydro-Kdo	4-1	4-5	4d8dNeu5Ac	4dAraHex	4dEry-ol	4dFuc	4dGal	4dNeu5Ac	4dThrHexNAcA4en	4eLeg5Ac7Ac	5-1	5-2	5-3	5-4	5-5	5-6	5dAraf	5dAraf3Me	5dLyxf3CFo	5dLyxf3CMe	5dPenf3CFo	6-1	6-3	6-4	6dAll	6dAll3Me	6dAlt	6dAltNAc	6dAltNAc1PP4N	6dAltNAc1PP4NAc	6dAltNAc3PCho	6dAltOAc	6dAltf	6dAltfOAc	6dFruf	6dGal	6dGalNAc	6dGul	6dHex	6dHexN	6dHexNAc4NAc	6dManHep	6dTal	6dTal1PP	6dTal2Ac	6dTal2Ac3Ac	6dTal2Ac3Ac4Ac	6dTal2Ac3Me	6dTal2Ac3Me4Ac	6dTal2Ac4Ac	6dTal2Me	6dTal2Me4Ac	6dTal3Me	6dTal4Ac	6dTalNAc	6dTalNAc1PP	6dTalNAc4Ac	6dTalNAcOAc	6dTalOAc	6dTalOAcOAc	6dTalOAcOMe	6dTalOMe	6dTalOMe-ol	6dTalf	7dNeu5Ac	8dNeu5Ac	8eAci5Ac7Ac	8eLeg	8eLeg5Ac7Ac	8eLeg5Ac7Ac8Ac	8eLeg5Ac7AcGro	8eLeg5But7Ac	8eLegNAcNBut	9dNeu5Ac	?1-3	?1-4	?1-?	?2-?	Abe	Abe1PP	Abe2Ac	AbeOAc	AcefA	Aci5Ac7Ac	AcoNAc	All	All-ol	All1S2S3S4S	All2Ac3Ac	All2S3S4S	All3Ac	All6Ac	AllN	AllN1P	AllNAc	AllNAc6Me	AllOMe	Alt	AltA	AltA2N	AltA2S	AltAN	AltNAc	AltNAcA	AltNAcA1Prop	Altf	AltfOAc	Api	ApiOAc	ApiOMe-ol	Apif	Ara	Ara-ol	Ara1Me	Ara1N4P	Ara1P4N	Ara1PP	Ara1PP2NAc	Ara1PP4N	Ara1PP4NFo	Ara2Ac	Ara2Ac3Ac4Ac	Ara2Ac4Ac	Ara2Ac5P-ol	Ara2Me	Ara2P	Ara3Ac	Ara3Ac4Ac	Ara3Me	Ara3N	Ara4Ac	Ara4N	Ara4S	AraN	AraNMeOMe	AraOAc	AraOAcOP-ol	AraOMe	AraOPN	Araf	Araf1Coum	Araf1Fer	Araf1Gro	Araf1P	Araf1PP	Araf2Ac3Ac5Ac	Araf2Me	Araf3Me	Araf3S	ArafGro	ArafOMe	Asc	Bac	Bac1N2Ac4Ac	Bac1PP2Ac	Bac1PP2Ac4Ac	Bac2Ac	Bac2Ac4Ac	Col	Col1PP	D-2,7-Anhydro-3dManHep-ulosonic	D-2dAraHex	D-2dAraHexA	D-3dAraHep-ulosonic	D-3dLyxHep-ulosaric	D-3dLyxHep2Me-ulosaric	D-3dManHep-ulosonic	D-3dThrHex-ulosonic	D-3dThrPen	D-3dXylHexOMe	D-4dAraHex	D-4dEryHexOAcN4en	D-4dLyxHep	D-4dLyxHep1Me	D-4dLyxHex	D-4dLyxHexOMe	D-4dThrHexA4en	D-4dThrHexAN4en	D-4dThrHexOAcN4en	D-4dXylHex	D-6dAllOMe	D-6dAlt	D-6dAltHep	D-6dAltHep3Me	D-6dAltHepf	D-6dAraHex	D-6dAraHexN	D-6dAraHexNAc	D-6dAraHexOMe	D-6dIdoHep	D-6dLyxHexOMe	D-6dManHep	D-6dManHep1P	D-6dManHep2Ac	D-6dManHep3Ac	D-6dManHepOAc	D-6dManHepOP	D-6dTal	D-6dTal-ol	D-6dTal2Ac	D-6dTal2Ac3Ac	D-6dTal2Ac4Ac	D-6dTal3Me	D-6dTal3Me-ol	D-6dTal4Ac	D-6dTalHep	D-6dTalOAc	D-6dTalOAcOMe	D-6dTalOMe	D-6dXylHex	D-6dXylHexN4Ulo	D-6dXylHexNAc4Ulo	D-6dXylHexOMe	D-7dLyxOct-ulosonic	D-9dThrAltNon-onic	D-All6Ac	D-AllN	D-Alt	D-Alt1Me	D-Alt2S3S4S	D-Alt3S4S	D-Apif	D-Apif1PP	D-Apif2Ac	D-ApifOAc	D-ApifOMe	D-Ara	D-Ara-aric	D-Ara-ol	D-Ara-onic	D-Ara1P-ol	D-Ara2S4S	D-Ara4S	D-Araf	D-Araf1Me	D-Araf2Ac3Ac5Ac	D-ArafN	D-Fuc	D-Fuc-ol	D-Fuc1CoumOMe	D-Fuc1FerOMe	D-Fuc1Gro	D-Fuc1Gro3NBut	D-Fuc2Ac	D-Fuc2Ac3Me	D-Fuc2Me	D-Fuc2Me3Me	D-Fuc2Me3Me4N	D-Fuc2Me4NAc	D-Fuc2S	D-Fuc3Ac	D-Fuc3Ac4Ac	D-Fuc3Me	D-Fuc3N	D-Fuc3NAlaAc	D-Fuc3NBut	D-Fuc3NBut4Ac	D-Fuc3NFo	D-Fuc3NLac	D-Fuc3S	D-Fuc4Ac	D-Fuc4CN	D-Fuc4Me	D-Fuc4N	D-Fuc4NBut	D-Fuc4NMe	D-Fuc4S	D-FucN	D-FucNAc	D-FucNAc-ol	D-FucNAc1Prop4N	D-FucNAc4Ac	D-FucNAc4N	D-FucNAc4NAc	D-FucNAc4NMe	D-FucNAcN	D-FucNAcNMe	D-FucNAcNMeN	D-FucNAcOAc	D-FucNAcOMe	D-FucNAcOP	D-FucNAcOPEtN	D-FucNAlaAc	D-FucNAsp	D-FucNBut	D-FucNFo	D-FucNMeN	D-FucNThrAc	D-FucOAc	D-FucOAcNGroA	D-FucOAcOBut	D-FucOAcOMe	D-FucOBut	D-FucOEtN	D-FucOMe	D-FucOMe1Coum	D-FucOMe1Fer	D-FucOMeOSin	D-FucOS	D-Fucf	D-Fucf2Ac	D-FucfNAc	D-FucfOAc	D-Ido	D-IdoA	D-IdoA2S	D-IdoNAc	D-IdoNAc1N	D-Lyx	D-Rha	D-Rha-ol	D-Rha1F4NFo	D-Rha1PP	D-Rha1PP4N	D-Rha1PP4NAc	D-Rha2Me	D-Rha2Me3Me4NFo	D-Rha2Me4Me	D-Rha2Me4N	D-Rha2Me4NBut	D-Rha2Me4NFo	D-Rha2S	D-Rha3Ac4Ac	D-Rha3CMe	D-Rha3Me	D-Rha3N	D-Rha3P	D-Rha4N	D-Rha4NAc	D-Rha4NBut	D-Rha4NFo	D-Rha4NLac	D-RhaCMe	D-RhaGro	D-RhaN	D-RhaNAc	D-RhaNAc2Me3Me	D-RhaNAcOAc	D-RhaNFo	D-RhaOMe	D-RhaOP	D-RhaOS	D-Sor	D-Sorf	D-Sorf1Cl4Cl6Cl	D-Thre-ol	DDAltHep	DDAltHep3Me	DDAltHepOMe	DDGalHep	DDGalHepOMe	DDGlcHep	DDManHep	DDManHep2PEtN7PEtN	DDManHep3P6P	DDManHep7PCho	DDManHepOAc	DDManHepOBut	DDManHepOEtN	DDManHepOMe	DDManHepOP	DDManHepOPEtN	DDManHepOPGroA	DDManHepPGroA	DL-3,9dGalNon5NAc7NAc-ulosonic	DL-3,9dGlcNon5NAm7Ac-ulosonic	DL-3,9dGlcNon5NAm7Am-ulosonic	DLGlcHep3Me6Me	DLGlcHep6Me	DLGlcHepOMe	DLHepGlcOMe	Dha	Dig	Dig3Ac	Dig3Ac4Ac	Dig3CMe	Dig3Fo	Dig3Fo4Fo	Dig3Me	Dig3Me4Me	Dig4Ac	Dig4Me	DigOAc	DigOMe	Erwiniose	Ery-ol	Ery-onic	Ery4Ac-ol	EryOMe-onic	Fru	Fru3MeOPN	Fruf	Fruf1Ac	Fruf1Ac4Ac	Fruf1Cl4Br6Cl	Fruf1Cl4Cl6Cl	Fruf1Cl4F6Cl	Fruf1Cl4I6Cl	Fruf1Cl4Me6Cl	Fruf1Cl6Cl	Fruf1CoumOAcOBz	Fruf1CoumOBz	Fruf1Fer	Fruf1FerOAc	Fruf1FerOBz	Fruf1S3S4S6S	Fruf3Ac	Fruf4Ac	Fruf4Ac6Ac	Fruf4F	Fruf6Ac	Fruf6Br	Fruf6F	Fruf6I	Fruf6Lau	Fruf6Me	Fruf6N	Fruf6NAc	Fruf6P	FrufOAc	FrufOAc1Fer	FrufOAcOBz1Coum	FrufOBz1Coum	FrufOBz1Fer	FrufOBzOCin	FrufOLau	Fuc	Fuc-ol	Fuc1N	Fuc1N4NBz7Et-ol	Fuc1P	Fuc1PP	Fuc1PamOMe	Fuc1VacOMe	Fuc2Ac	Fuc2Ac3Ac4Ac	Fuc2Me	Fuc2Me3Me	Fuc2Me3Me4Ac	Fuc2Me3Me4Me	Fuc2Me3S	Fuc2Me4Ac	Fuc2Me4Me	Fuc2Me4NAc	Fuc2N	Fuc2NAm	Fuc2S	Fuc2S3S4S	Fuc2S4S	Fuc3Ac	Fuc3Ac4Ac	Fuc3Me	Fuc3Me4Me	Fuc3N	Fuc3NBut4Ac	Fuc3NGly	Fuc3NMe	Fuc3S	Fuc3S4S	Fuc4Ac	Fuc4Me	Fuc4N	Fuc4NBut	Fuc4S	FucN	FucNAc	FucNAc-ol	FucNAc1PP	FucNAc3Ac	FucNAc4NMe	FucNAcA	FucNAcN	FucNAcNMe	FucNAcOAc	FucNAcPGro	FucNAla	FucNAm	FucNAm1Me	FucNAm3Ac	FucNBut	FucNFo	FucNProp	FucNThrAc	FucOAc	FucOAcNAm	FucOAcOMe	FucOAcOSOMe	FucOMe	FucOMe1Pam	FucOMe1Vac	FucOPOMe	FucOS	FucOSOMe	Fucf	FucfNAc	Fus5Ac	Fus5Am	Gal	Gal-ol	Gal-onic	Gal1Cer	Gal1Cer3S	Gal1Et	Gal1EtN	Gal1Gro	Gal1Me	Gal1Me3P	Gal1P	Gal1PGro	Gal1PGro2Ac3Ac	Gal1PP	Gal1S	Gal2Ac	Gal2Ac3Ac	Gal2Ac3Ac4Ac	Gal2Ac3Ac4Ac6Ac	Gal2Ac3Ac4Pyr	Gal2Ac3Ac6Ac	Gal2Ac4Ac	Gal2Ac4Ac6Ac	Gal2Ac4Pyr	Gal2Et3S4S6Et	Gal2Et4S6Et	Gal2F	Gal2F3Me	Gal2Me	Gal2Me3Me	Gal2Me3Me4Me	Gal2Me6Me	Gal2N	Gal2NAla	Gal2PCho	Gal2PGro	Gal2PGro6MeOPN	Gal2Pyr	Gal2S	Gal2S3S	Gal2S3S4S6S	Gal2S6S	Gal3Ac	Gal3Ac4Ac	Gal3Ac4Ac6Ac	Gal3Ac6Ac	Gal3CN	Gal3Cl6Cl	Gal3F	Gal3Lac	Gal3Me	Gal3Me4Cl6Cl	Gal3Me4S	Gal3Me6S	Gal3N	Gal3NAc	Gal3P	Gal3P4P	Gal3PCho	Gal3PCho6PEtN	Gal3PGro	Gal3Pyr	Gal3Pyr4Pyr	Gal3S	Gal3S4S	Gal3S6Et	Gal3S6S	Gal4Ac	Gal4Ac6Ac	Gal4Cl	Gal4F	Gal4Me	Gal4Me6Me	Gal4N	Gal4NAc	Gal4NAc5NAc-onic	Gal4P	Gal4P6P	Gal4PGro	Gal4Pyr	Gal4Pyr6Pyr	Gal4S	Gal4S6S	Gal5NAc-ol	Gal6Ac	Gal6Aep	Gal6F	Gal6Lac-ol	Gal6Me	Gal6N	Gal6NAc	Gal6P	Gal6PCho	Gal6PChoOAc	Gal6PEtN	Gal6PGro	Gal6Pyr	Gal6S	Gal6S-ol	Gal6ulo	GalA	GalA-ol	GalA1Me	GalA1P	GalA1P6N	GalA1PP	GalA1PP2NAc	GalA1Prop	GalA2Ac	GalA2Ac3Ac	GalA2Ac4Fo	GalA2N	GalA2NAc	GalA2NAc3Ac	GalA2NAc3Ac4Me	GalA2NAc3Ac6N	GalA2NAc3NAc6N	GalA2NAc6Me	GalA2NAc6N	GalA2NFo	GalA2S	GalA2S3S	GalA2S3S6Me	GalA3Ac	GalA3Ac4Ac6GroN	GalA3Ac6Thr	GalA3Me	GalA3Me4Ac6Me	GalA3P	GalA4Ac	GalA4Ac6Ser	GalA4Me	GalA4PEtN6Lys	GalA6Ala	GalA6CetLys	GalA6Lys	GalA6Me	GalA6N	GalA6Ser	GalA6Thr	GalA6ThrAc	GalAAla	GalAAlaLys	GalAGroN	GalALys	GalAN	GalANCys	GalANCysAc	GalANSerAc	GalAOAc	GalAOAcGroN	GalAOAcNAm	GalAOAcOLac	GalAOAcOMe	GalAOAcThr	GalAOLac	GalAOMe	GalAOP	GalAOPEtN	GalAOPyr	GalAP3	GalASer	GalAThr	GalGro	GalGroN	GalN	GalN-ol	GalN1P	GalN1PP	GalN2Ac	GalN2Ala	GalN2Suc	GalN2Suc-ol	GalN6Me	GalN6PEtN	GalNAc	GalNAc-ol	GalNAc1EtN	GalNAc1Me	GalNAc1N	GalNAc1P	GalNAc1P3Ac	GalNAc1PGro	GalNAc1PP	GalNAc1PP4S	GalNAc1PP4S6S	GalNAc3Ac	GalNAc3Ac4Ac6Ac	GalNAc3Ac4PGro	GalNAc3Me	GalNAc3P	GalNAc3PCho	GalNAc3PGro	GalNAc3PGro6Ac	GalNAc3PGroAN	GalNAc3S	GalNAc4Ac	GalNAc4Ac6Ac	GalNAc4Me	GalNAc4PEtN	GalNAc4PGro	GalNAc4Pyr	GalNAc4S	GalNAc4S-ol	GalNAc4S6S	GalNAc6Ac	GalNAc6Aep	GalNAc6Me	GalNAc6P	GalNAc6PCho	GalNAc6PEtN	GalNAc6PGro	GalNAc6S	GalNAc6S-ol	GalNAcA	GalNAcA3Ac	GalNAcA3Ac6N	GalNAcA3Me	GalNAcA3Myr	GalNAcA4Ac	GalNAcA6Ala	GalNAcA6N	GalNAcAAla	GalNAcAN	GalNAcAOAc	GalNAcAOAcN	GalNAcASer	GalNAcGro	GalNAcN	GalNAcOAc	GalNAcOAcOP	GalNAcOMe	GalNAcOP	GalNAcOPCho	GalNAcOPEtN	GalNAcOPGro	GalNAcOS	GalNAcPGro	GalNAla	GalNAmA	GalNBz	GalNCysGly	GalNFoA	GalNFoA3Ac6N	GalNFoA6N	GalNFoAN	GalNOAc	GalNPCho	GalOAc	GalOAcN	GalOAcNAla	GalOAcNFoA	GalOAcNFoAN	GalOAcOMe	GalOAcOP	GalOAcOPGro	GalOAcOPyr	GalOAcPGro	GalOFoAN	GalOLac	GalOLac-ol	GalOMe	GalOMeF	GalOMeNAla	GalOP	GalOPCho	GalOPEtN	GalOPGro	GalOPyr	GalOS	GalPCho	GalPGro	GalcNAc6P	Galf	Galf1Bn	Galf1Et	Galf1Me	Galf1Oc	Galf1P	Galf1PP	Galf2Ac	Galf2Ac3Ac5Ac6Ac	Galf3Ac	Galf3Ac5Ac	Galf3Ac6Ac	Galf3Lac	Galf4Pyr	Galf5Ac6Ac	Galf5P	Galf5Pyr	Galf6Ac	Galf6P	Galf6PCho	Galf6PGro	GalfGro	GalfNAc	GalfOAc	GalfOAcGro	GalfOAcOLac	GalfOAcOPGro	GalfOAcPGro	GalfOP	GalfOPCho	GalfOPGro	GalfPCho	GalfPGro	Glc	Glc-ol	Glc-onic	Glc1	Glc1Beh6Ac	Glc1Cer	Glc1Cer6Aep	Glc1Coum	Glc1Coum6Ac	Glc1Et	Glc1EtN	Glc1EtN2Ac	Glc1F	Glc1Fer	Glc1Fer6Ac	Glc1Gro	Glc1Gro6PEtN	Glc1GroA	Glc1Hxo	Glc1Lin	Glc1Lin6Ac	Glc1Me	Glc1Me2S3Me6S	Glc1Me2S3S6S	Glc1N	Glc1N-ol	Glc1N-onic	Glc1N4Me	Glc1NAc	Glc1NGc	Glc1Oco	Glc1Ole	Glc1Ole3Ac4Ac	Glc1Ole3Ac4Ac6Ac	Glc1Ole3P4P6Ac	Glc1Ole3Pp4Pp	Glc1Ole6Ac	Glc1P	Glc1P2Lau	Glc1P2Lau3Dco	Glc1P2Lau3Lau	Glc1P2Myr3Myr	Glc1P6Ac	Glc1PEtN	Glc1PGro	Glc1PP	Glc1PP3N	Glc1PP6S	Glc1Pam	Glc1Pam6Ac	Glc1PamOPN	Glc1S	Glc1S2Ac3Ac6Ac	Glc1Ste6Ac	Glc2Ac	Glc2Ac3Ac	Glc2Ac3Ac4Ac	Glc2Ac3Ac4Ac6Ac	Glc2Ac3Ac4PGro	Glc2Ac3Ac5Ac6Ac	Glc2Ac3Ac6Ac	Glc2Ac3S	Glc2Ac4Ac6Ac	Glc2Ac4PGro	Glc2Ac6Ac	Glc2Ac6S	Glc2Br	Glc2Br3Ac4Ac6Br	Glc2Et3S4S6Et	Glc2Et4S6Et	Glc2F	Glc2Gc	Glc2Gc3Gc4Gc	Glc2GroA	Glc2GroA6Ac	Glc2Hxo6Ac	Glc2Lau3Dco	Glc2Lau3Dco4P	Glc2Lau3Lau4P	Glc2Me	Glc2Me3Me4Me	Glc2Me3Me4Me6Me	Glc2Me3Me4Me6S	Glc2Me3Me5Me6Me-ol	Glc2Me3Me6Me	Glc2Me3Me6S	Glc2Me4Me	Glc2Me6N	Glc2Myr3Myr4P	Glc2NAc3NAc-aric	Glc2Oco3Ac	Glc2Ole6AcNCm	Glc2P	Glc2P3P6Ac	Glc2PGro	Glc2Pam	Glc2Pam6AcNCm	Glc2Pp3Pp6Ac	Glc2S	Glc2S3Me4Me6S	Glc2S3Me6S	Glc2S3S	Glc2S3S4Me6S	Glc2S3S4S	Glc2S3S4S6S	Glc2S3S5S6S-onic	Glc2S3S6S	Glc2S4S	Glc2S4S6S	Glc2S6SN	Glc2Ste	Glc2Vac6AcNCm	Glc2Vac6AcNMe	Glc2Vac6AcNOCm	Glc3Ac	Glc3Ac4Ac	Glc3Ac4Ac6Ac	Glc3Ac4PGro	Glc3Ac6Ac	Glc3F	Glc3Gc	Glc3Gc4Gc	Glc3Lac	Glc3Me	Glc3Me4Pyr	Glc3Me6Me	Glc3Me6S	Glc3N	Glc3NAc	Glc3P	Glc3P-ol	Glc3P4P	Glc3P4P6Ac	Glc3PEtN6PEtN	Glc3PGro	Glc3S	Glc3S-ol	Glc3S4S	Glc3S4S6S	Glc3S6Et	Glc3S6S	Glc4Ac	Glc4Ac6Ac	Glc4Ac6PCho	Glc4Lac	Glc4Me	Glc4Me6Me	Glc4N	Glc4P	Glc4PEtN	Glc4PGro	Glc4Pyr	Glc4S	Glc4S6S	Glc5CF	Glc5N	Glc5S	Glc6Ac	Glc6Ac-ol	Glc6Ac1Coum	Glc6Ac1Fer	Glc6AcGro	Glc6AcGroA	Glc6AcNBut	Glc6AcNCm2Ole	Glc6AcNCm2Pam	Glc6AcNCm2Vac	Glc6AcNMe2Vac	Glc6AcNMeOCm	Glc6AcNMeOCm2Vac	Glc6AcNOCm2Vac	Glc6AcOP	Glc6AcOPGro	Glc6AcPGro	Glc6F	Glc6I	Glc6Me	Glc6Me-onic	Glc6N	Glc6NAc	Glc6P	Glc6P-ol	Glc6PCho	Glc6PEtN	Glc6PGro	Glc6PGroA	Glc6PGroAc	Glc6S	Glc6S-ol	Glc6Thr	Glc6uloN	GlcA	GlcA1Cer	GlcA1Gro	GlcA1Me2NAc	GlcA1P	GlcA1PGroA6N	GlcA1PP	GlcA1PP2NAc	GlcA1PP2NAc3N	GlcA1PP2NAc3NAc	GlcA2Ac	GlcA2Ac3Ac	GlcA2Me	GlcA2Me3Me	GlcA2Me4Me	GlcA2N	GlcA2NAc	GlcA2NAc3N	GlcA2NAc3N6N	GlcA2NAc3NAc	GlcA2NAc3NAc4Ac	GlcA2NAc3NAc6N	GlcA2NAc4Me	GlcA2Pyr	GlcA2Pyr3Pyr	GlcA2S	GlcA2S3Ac	GlcA2S3Me	GlcA2S3S	GlcA3Ac	GlcA3Fo4Me	GlcA3Lac	GlcA3N	GlcA3NAc	GlcA3S	GlcA3S6Me	GlcA4Ac	GlcA4Ac6Ser	GlcA4Lac	GlcA4Me	GlcA4Me6Me	GlcA4Me6N	GlcA6Ac	GlcA6Ala	GlcA6CetLys	GlcA6EtN	GlcA6Gly	GlcA6GroN	GlcA6Lys	GlcA6Me	GlcA6N	GlcA6S	GlcA6Ser	GlcA6Thr	GlcA6ThrAc	GlcAAlaLys	GlcAGlu	GlcAGro	GlcAGroN	GlcALys	GlcAN	GlcAN2But3NBut	GlcAOAc	GlcAOBut	GlcAOEtN	GlcAOLac	GlcAOMe	GlcAOP	GlcAOPyr	GlcAOS	GlcASer	GlcCho	GlcGro	GlcGroA	GlcN	GlcN-ol	GlcN-onic	GlcN1Me2S6S	GlcN1N	GlcN1N2Gc	GlcN1P	GlcN1P2Ach3Myr	GlcN1P2Dco3Dco	GlcN1P2Dco3Myr	GlcN1P2Lau	GlcN1P2Lau3Dco	GlcN1P2Lau3Lau	GlcN1P2Mar3Pam	GlcN1P2Myr	GlcN1P2Myr3Dco	GlcN1P2Myr3Lau	GlcN1P2Myr3Myr	GlcN1P2Pam	GlcN1P2Pam3Myr	GlcN1P2Ste3Myr	GlcN1P2Ste3Pam	GlcN1P2Ste3Ste	GlcN1P3N	GlcN1PEtN	GlcN1PEtN2Myr3Myr	GlcN1PEtN2Ste3Pam	GlcN1PLau3Dco	GlcN1PP	GlcN1PP2Lau	GlcN1PP2Myr3Myr	GlcN1PPEtN2Dco3Dco	GlcN1PPEtN2Lau3Lau	GlcN1PPEtN2Myr3Lau	GlcN1PPEtN2Myr3Myr	GlcN1PPEtN2Myr3NMyr	GlcN1PPEtN2Ste3NPam	GlcN1Ste2Myr3N	GlcN1Vac	GlcN2Ac	GlcN2Ach3Myr4P	GlcN2Ach3NPam4P	GlcN2Ala	GlcN2Ala3Ac	GlcN2AlaAc	GlcN2But	GlcN2But3NFoA6N	GlcN2Dco3Dco4P	GlcN2Dco3Dco4PPEtN	GlcN2Dco3Myr3P	GlcN2Dco4P	GlcN2Fo	GlcN2Gc	GlcN2Gly	GlcN2Lau3Dco4P	GlcN2Lau3Lau4P	GlcN2Lau3Myr4P	GlcN2Lau4P	GlcN2Mar	GlcN2Mar3Myr	GlcN2Mar3Pam	GlcN2Me	GlcN2Me2Ole3Cm	GlcN2Me2Ole4Cm	GlcN2Me2Ole6Cm	GlcN2Me3Cm4Cm6Cm	GlcN2Me3Me4P	GlcN2Myr	GlcN2Myr3Dco	GlcN2Myr3Dco4P	GlcN2Myr3Lau	GlcN2Myr3Lau4P	GlcN2Myr3Lau4PPEtN	GlcN2Myr3Myr	GlcN2Myr3Myr4P	GlcN2Myr3Myr4PEtN	GlcN2Myr3Myr4PP	GlcN2Myr3Myr4PPEtN	GlcN2Myr3NLau	GlcN2Myr3NMyr	GlcN2Myr3NMyr4P	GlcN2Myr3NMyr4PPEtN	GlcN2Myr3NPam	GlcN2Myr3Pam4P	GlcN2Myr4P	GlcN2Ole	GlcN2Ole6Ac	GlcN2Pam	GlcN2Pam-onic	GlcN2Pam3Myr	GlcN2Pam3Myr-onic	GlcN2Pam3Myr4P	GlcN2Pam3NMyr	GlcN2Pam3NMyr4P	GlcN2Pam4P	GlcN2Pam6Ac	GlcN2S	GlcN2S-ol	GlcN2S3Me4Me6S	GlcN2S3S	GlcN2S3S6S	GlcN2S4Me6S	GlcN2S6S	GlcN2S6S-ol	GlcN2Ste	GlcN2Ste-onic	GlcN2Ste3Myr	GlcN2Ste3Myr-onic	GlcN2Ste3NMyr	GlcN2Ste3Pam4P	GlcN2Suc	GlcN2Vac	GlcN2Vac6Ac	GlcN3Ac4Ac6Ac	GlcN3Lau4P	GlcN3N	GlcN3N4P	GlcN3N4PP	GlcN3N4PPEtN	GlcN3NMyr	GlcN3S	GlcN3S6S	GlcN4Ac	GlcN4P	GlcN4P6Ac	GlcN4PEtN	GlcN4PP	GlcN4PPEtN	GlcN6Ac	GlcN6Aep	GlcN6Me	GlcN6N	GlcN6P	GlcN6PCho	GlcN6PEtN	GlcN6S	GlcNAC-ol	GlcNAc	GlcNAc-ol	GlcNAc-onic	GlcNAc1Cer	GlcNAc1EtN	GlcNAc1Gro	GlcNAc1Me	GlcNAc1Me6S	GlcNAc1N	GlcNAc1N-ol	GlcNAc1N3N	GlcNAc1N3S	GlcNAc1N5CN	GlcNAc1N6Me	GlcNAc1N6N	GlcNAc1NAc	GlcNAc1Ole6Ac	GlcNAc1OleOAcOCm	GlcNAc1P	GlcNAc1P-ol	GlcNAc1P4PCho	GlcNAc1PGro	GlcNAc1PP	GlcNAc1PP3P	GlcNAc1Pam6Ac	GlcNAc1PamOAcOCm	GlcNAc1Prop	GlcNAc1S	GlcNAc1Ser	GlcNAc1Thr	GlcNAc1VacOAc	GlcNAc1VacOAcOCm	GlcNAc2Ala	GlcNAc2GroA6P	GlcNAc3Ac	GlcNAc3Ac4Ac	GlcNAc3Ac4Ac6Ac	GlcNAc3Ac4PGro	GlcNAc3Ac4Pyr	GlcNAc3Ac6Ac	GlcNAc3Lac	GlcNAc3Me	GlcNAc3N	GlcNAc3N4Ac6N	GlcNAc3NAc	GlcNAc3NAc4Ac	GlcNAc3Prop	GlcNAc3S	GlcNAc3S-ol	GlcNAc3S4S6S	GlcNAc3S6S	GlcNAc4Ac	GlcNAc4Dhpa	GlcNAc4F	GlcNAc4Lac	GlcNAc4Lac6Ac	GlcNAc4Me	GlcNAc4Me6Me	GlcNAc4N	GlcNAc4NAc	GlcNAc4P	GlcNAc4P-ol	GlcNAc4PCho6P	GlcNAc4PGro	GlcNAc4Pyr	GlcNAc6AEP	GlcNAc6Ac	GlcNAc6Aep	GlcNAc6Cl	GlcNAc6Gc	GlcNAc6I	GlcNAc6Me	GlcNAc6N	GlcNAc6NAc	GlcNAc6P	GlcNAc6P-ol	GlcNAc6PCho	GlcNAc6PEtN	GlcNAc6PEtNAc	GlcNAc6PEtg	GlcNAc6PGro	GlcNAc6Pyr	GlcNAc6S	GlcNAc6S-ol	GlcNAcA	GlcNAcA3Ac	GlcNAcA3Ac4NAc	GlcNAcA3N	GlcNAcA3NAc	GlcNAcA3NAc4Ac	GlcNAcA3NAc6N	GlcNAcA3NAlaFo6N	GlcNAcA3NAm	GlcNAcA3NBut	GlcNAcA3NFoAla6N	GlcNAcA3NSucAc6N	GlcNAcA3S	GlcNAcA6Ala	GlcNAcA6Gly	GlcNAcAAla	GlcNAcAN	GlcNAcANAla	GlcNAcANAlaAc	GlcNAcANAlaFo	GlcNAcAOAc	GlcNAcAOMe	GlcNAcAla	GlcNAcGlu	GlcNAcGly	GlcNAcGro	GlcNAcN	GlcNAcN-ol	GlcNAcNAla	GlcNAcNAlaFo	GlcNAcNAmA	GlcNAcOAc	GlcNAcOAc1Vac	GlcNAcOAcNAla	GlcNAcOAcOCm1Ole	GlcNAcOAcOCm1Pam	GlcNAcOAcOCm1Vac	GlcNAcOAcOLac	GlcNAcOAcOS-ol	GlcNAcOLac	GlcNAcOLacAla	GlcNAcOLacGro	GlcNAcOMe	GlcNAcOP	GlcNAcOPCho	GlcNAcOPEtN	GlcNAcOPEtg	GlcNAcOPGro	GlcNAcOPGroA	GlcNAcOPOAch	GlcNAcOPyr	GlcNAcOS	GlcNAcOS-ol	GlcNAcPCho	GlcNAcPGro	GlcNAcPGroA	GlcNAm	GlcNAmA	GlcNBut	GlcNButOAc	GlcNCm1OleOCm	GlcNCm1Vac	GlcNCm1VacOCm	GlcNCmOCm	GlcNCmOCm1Ole	GlcNCmOCm1Vac	GlcNGc	GlcNGly	GlcNMe	GlcNMe1PamOCm	GlcNMe1Vac	GlcNMe1VacOCm	GlcNMe2Vac	GlcNMe2Vac3Cm4Cm	GlcNMeOCm	GlcNMeOCm1Pam	GlcNMeOCm1Vac	GlcNMeOCm2Pam	GlcNMeOCm2Vac	GlcNMeOCmOSte	GlcNMeOSte	GlcNOAc	GlcNOCm1Vac	GlcNOCmOAch	GlcNOMar	GlcNOMyr	GlcNOP	GlcNOPEtN	GlcNOPyr	GlcNP3NFoA6N	GlcNProp	GlcNS3S	GlcNS3S6S	GlcNS6S	GlcOAc	GlcOBz	GlcOCm2Vac6AcNMe	GlcOCm6AcNMe	GlcOEtNN	GlcOGly	GlcOLac	GlcOMal	GlcOMe	GlcOMe-ol	GlcOMeN	GlcOMeNOMyr	GlcOMeOPyr	GlcOP	GlcOP-ol	GlcOP1Ole	GlcOPCho	GlcOPChoGro	GlcOPEtN	GlcOPEtNN	GlcOPGro	GlcOPN	GlcOPN1Pam	GlcOPNOMyr	GlcOPPEtN	GlcOPyr	GlcOS	GlcOSN	GlcOSNMeOCm	GlcOSin	GlcPCho	GlcPChoGro	GlcPGro	GlcS	GlcThr	Glcf	Gul	Gul-onic	GulA	GulN	GulNAc	GulNAc1N	GulNAc1N6Me	GulNAcA	GulNAcAN	GulNAcANAm	Hep	Hep3Me6Me	Hep4P	HepOP	Hex	Hex-ol	HexA	HexA2NAc3NAc	HexA2S	HexA6S	HexN	HexN2Me	HexNAc	HexNAc-ol	HexNAcOPCho	HexNAcOPEtN	HexNAcOS	HexOAc	HexOMe	HexOMeOFo	HexOS	Hexf	Ido	Ido-onic	Ido2S	IdoA	IdoA1Me2S	IdoA1PP	IdoA2Ac3Ac	IdoA2Me3Me	IdoA2S	IdoA2S3Ac	IdoA2S3Et	IdoA2S3Me	IdoA2S3S	IdoA2S4Me	IdoA2S6Me	IdoA2S6S	IdoA3S	IdoAOS	IdoN	IdoN6N	IdoNAc	IdoNAc1N	IdoNAc6NAc	Ins	Ins3PEtN	Kdn	Kdn1N	Kdn2P	Kdn5Ac	Kdn7Pyr	Kdn8Me	Kdn9Ac	Kdn9Me	KdnNAc	KdnOMe	Kdo	Kdo-ol	Kdo1Me	Kdo1N	Kdo2Me	Kdo2P	Kdo2P8N	Kdo2PGro	Kdo4Ac	Kdo4Ac5Ac	Kdo4Ac5S	Kdo4P	Kdo4P8P	Kdo4PPEtN	Kdo4PPEtN8N	Kdo5Me	Kdo5P	Kdo5PGro	Kdo5S	Kdo7Ac	Kdo7Me	Kdo7P	Kdo7PEtN	Kdo7Pyr	Kdo8Ac	Kdo8P	Kdo8PEtN	Kdo8Pp	KdoN	KdoOAc	KdoOMe	KdoOP	KdoOPEtN	KdoOPN	KdoOPOEtN	KdoOPPEtN	KdoOPPEtNN	Kdof	Ko	Ko2Me	KoOMe	KoOPEtN	L-2dThrPen4N	L-2dThrPen4NMe	L-4dEry-ol	L-4dEryHexAN4en	L-4dThrHex4en	L-4dThrHexA4en	L-4dThrHexA4en6N	L-4dThrHexA4enAla	L-4dThrHexAN4en	L-4dThrHexNAcA4en6N	L-4dThre-ol	L-6dAll	L-6dAraHex	L-6dAraHexOMe	L-6dGalHep	L-6dGalHepOP	L-6dGalHepf	L-6dGul	L-6dGulHep	L-6dGulHepOMe	L-6dGulHepOP	L-6dGulHepf	L-6dXylHexNAc4Ulo	L-All	L-Dig	L-Dig3Me	L-Dig4Me	L-DigOMe	L-Ery-ol	L-Fru	L-Gal	L-Gal-onic	L-Gal1PP	L-Gal2S	L-Gal3S	L-Gal6S	L-GalA2N	L-GalA2NAc	L-GalA2NAc3NAc	L-GalA2NAc4Ac	L-GalA3Me	L-GalANAm3Ac	L-GalAOAcNAm	L-GalNAc	L-GalNAc-onic	L-GalNAcA	L-GalNAcA3Ac	L-GalNAcAN	L-GalNAcAOAc	L-GalNAmA	L-GalOS	L-Glc	L-Glc2S3S	L-Glc3Me	L-Glc3Me6Me	L-GlcA	L-GlcN2Me	L-GlcN2Me3P	L-GlcNAc	L-GlcOMe	L-Gul	L-Gul-onic	L-Gul1PP	L-Gul4NAc5NAc-onic	L-GulA	L-GulA2N	L-GulA2NAc	L-GulA2NAc3Et	L-GulA2NAc3N	L-GulA2NAc3NAc	L-GulA2NAc3NAm	L-GulA2S	L-GulAN	L-GulNAc	L-GulNAc3Ac	L-GulNAcA	L-GulNAcA3Ac6Gly	L-GulNAcA3NAc	L-GulNAcA3NAm	L-GulNAcA6Gly	L-GulNAcAN	L-GulNAcANAm	L-GulNAcANEtN	L-GulNAcAOAc	L-GulNAcAOAcN	L-GulNAcAOEtN	L-Lyx	L-Man	L-Man-ol	L-Man2Me4Me	L-Man3Me	L-Man6Me	L-ManNAc	L-Oli	L-Oli3CMe	L-Oli3CMe4Ac	L-Oli3CNMe	L-Oli3Me	L-Oli3Me4Ac	L-Oli4Me	L-Psif	L-Qui	L-Qui2Me4N	L-Qui3Ac4Ac	L-Qui3NAc	L-Qui3NAc4Me	L-Qui4N	L-QuiN	L-QuiNAc	L-QuiNAc4P	L-QuiNAcOMe	L-QuiNAcOP	L-Ribf	L-Tal	L-TalNAc	L-Xyl	L-Xyl1N4Me	L-Xyl1N4Me-onic	L-Xyl3Me	L-XylOMe	LDIdoHep	LDIdoHepPro	LDManHep	LDManHep1Me4P	LDManHep2Ac	LDManHep2Gly4P	LDManHep2P4P	LDManHep2PPEtN	LDManHep2PPEtN4P	LDManHep3P	LDManHep3PEtN	LDManHep4P	LDManHep4P6Gly	LDManHep4P6P	LDManHep4PEtN	LDManHep4PEtN7PEtN	LDManHep4POGly	LDManHep4PPEtN	LDManHep6P	LDManHep6P7Cm	LDManHep6PEtN	LDManHep6PPEtN	LDManHep7P	LDManHep7PEtN	LDManHepGly	LDManHepGroN	LDManHepOAc	LDManHepOCm	LDManHepOEtN	LDManHepOGly	LDManHepOMe	LDManHepOP	LDManHepOPEtN	LDManHepOPGroA	LDManHepOPOCm	LDManHepOPOMe	LDManHepOPOPEtN	LDManHepOPOPPEtN	LDManHepOPPEtN	LDManHepPGroA	Leg	Leg2P5Ac7Ac	Leg4Ac5Ac7Ac	Leg5Ac	Leg5Ac7Ac	Leg5Ac7Ala	Leg5Ac7But	Leg5Am7Ac	Leg5But7Ac	Leg5Fo7Ac	LegNAc	LegNAcAla	LegNAcNAla	LegNAcNAm	LegNAcNBut	LegNFo	Lyx	Lyx-ol	Lyx2Me	Lyx2N-ol	Lyxf	Lyxf3CFo	Man	Man-ol	Man-onic	Man1Cer	Man1Et	Man1EtN	Man1Me	Man1Me2Et	Man1Me2S3S6S	Man1Me4Me	Man1N	Man1N-ol	Man1P	Man1P-ol	Man1PEtN-ol	Man1PP	Man1Prop	Man1S	Man1S2Ac3Ac4Ac	Man1S2S4S6S	Man1S3S4S6S	Man1Ser	Man2Ac	Man2Ac3Ac4Ac	Man2Ac3Ac4Ac6Ac	Man2Ac4Ac6Ac	Man2Ac6Ac	Man2Br	Man2But	Man2But6Ac	Man2Cl6Cl	Man2Et	Man2F	Man2Me	Man2Me4N	Man2Me6Me	Man2N	Man2N-ol	Man2Oco3Hxo4Hxo6Hxo	Man2Oco3Oco4Oco6Oco	Man2Oco6Ac	Man2P	Man2PEtN	Man2PMe	Man2S	Man2S3S4S6P	Man2S3S6S	Man2S4S6S	Man2S6S	Man3Ac	Man3CMe	Man3CN	Man3Et	Man3Fo	Man3Me	Man3N	Man3P	Man3PGro	Man3PMe	Man3S	Man3S4S6S	Man3S6S	Man4Ac	Man4Ac6Ac	Man4CN	Man4Dhpa	Man4Lac	Man4Me	Man4Me6Me	Man4N	Man4Pyr	Man4S	Man4Suc	Man5P-ol	Man6AEP	Man6Ac	Man6Aep	Man6F	Man6Me	Man6N	Man6P	Man6P-ol	Man6PCho	Man6PEtN	Man6S	ManA	ManA1PP	ManA1PP2NAc	ManA1PP2NAc3NAc	ManA2Ac	ManA2Ac3Ac	ManA2NAc	ManA2NAc3N	ManA2NAc3NAc	ManA2NAc3NAc6N	ManA2NAc3NAm	ManA2NAc6P	ManA6Me	ManAOAc	ManN	ManN-ol	ManN-onic	ManN1N-ol	ManN2But	ManN3N	ManNAc	ManNAc-ol	ManNAc1Me	ManNAc1Me3Ac	ManNAc1N	ManNAc1P	ManNAc1P3Ac	ManNAc1P3Ac4Ac	ManNAc1P4Ac	ManNAc1PP	ManNAc2NAc	ManNAc2NAc6Thr	ManNAc3Ac	ManNAc4Ac	ManNAc4Ac6Ac	ManNAc4Lac	ManNAc4P	ManNAc4PGroA	ManNAc4Pyr	ManNAc6Ac	ManNAc6PEtN	ManNAcA	ManNAcA1Gro3NAc	ManNAcA2NAc	ManNAcA2NAc4Me	ManNAcA3NAc	ManNAcA3NAc6Ala	ManNAcA3NAc6N	ManNAcA3NAm	ManNAcA3NAm6Thr	ManNAcA4Ac	ManNAcA4Me6N	ManNAcA6Thr	ManNAcAAla	ManNAcAN	ManNAcANAm	ManNAcANEtN	ManNAcANOOrn	ManNAcAOAc	ManNAcASer	ManNAcGroA	ManNAcOAc	ManNAcOMe	ManNAcOPGro	ManNAcOPyr	ManNAcPGro	ManNOPGro	ManNPGro	ManOAc	ManOAcN	ManOAcOMe	ManOAcOPyr	ManOEtN	ManOLac	ManOMe	ManOP	ManOP-ol	ManOPCho	ManOPEtN	ManOPOMe	ManOPOPyr-ol	ManOPyr	ManOS	ManPMe	Manf	Manf1Me	Manf1Me5P	Monosaccharide	Mur	MurN	MurNAc	MurNAc-ol	MurNAc1Me	MurNAc1PP	MurNAc6Ac	MurNAc8Ala	MurNAcAla	MurNAcOP	MurNAcSer	Neu	Neu1Me4Ac5Ac7Ac8Ac9Ac	Neu1Me5Ac	Neu1N5Ac	Neu1N5Gc	Neu1NMe5Ac	Neu2P5Ac	Neu2P5Gc	Neu4Ac	Neu4Ac5Ac	Neu4Ac5Ac6Ac	Neu4Ac5Ac7Ac	Neu4Ac5Ac7Ac8Ac9Ac	Neu4Ac5Ac9Ac	Neu4Ac5Gc	Neu4Ac7Ac9Ac	Neu4Ac9Ac	Neu4Gc5Ac	Neu4Me5Ac	Neu4Me5Ac9Me	Neu4NAc5Ac	Neu5Ac	Neu5Ac6Ac	Neu5Ac7Ac	Neu5Ac7Ac8Ac	Neu5Ac7Ac9Ac	Neu5Ac8Ac	Neu5Ac8Me	Neu5Ac8S	Neu5Ac9Ac	Neu5Ac9Me	Neu5Ac9N	Neu5Ac9NAc	Neu5AcNAc	Neu5AcOAc	Neu5AcOMe	Neu5AcOS	Neu5Fo	Neu5Gc	Neu5Gc7Ac	Neu5Gc8Me	Neu5Gc8S	Neu5Gc9Ac	Neu5Gc9Me	Neu5GcOAc	Neu5GcOLac	Neu5GcOMe	Neu5GcOS	Neu5Pp	Neu7Ac9Ac	Neu8Me	Neu9Ac	NeuNAc	Oli	Oli1Me	Oli3CMe	Oli3Me	Oli3N	Oli3NAc	Oli4Me	Par	Par1PP	Parf	Pau3Me	Pau3Me7Ac	Pau3Me7But	Pau3Me7Pp	Pau3Me7Vl	Pen	PenOMe	Penf	PenfOMe	PerNAc	Pse	Pse2Gro5Ac7Ac	Pse2P5Ac7Ac	Pse4Ac5Ac7Ac	Pse4Ac5Ac7But	Pse5Ac	Pse5Ac7Ac	Pse5Ac7AcNBut	Pse5Ac7AcOBut	Pse5Ac7But	Pse5Ac7Fo	Pse5Am7Gc	Pse5Am7Gra	Pse5Am7GroA	Pse5But7Ac	Pse5But7Fo	Pse7Fo	PseNAc	PseNAcNAm	PseNAcNBut	PseNAcNFo	PseNAcNGro	PseNAcOAcNBut	PseNAcOBut	PseNButNFo	Psif	Qui	Qui-ol	Qui2F	Qui2Me4N	Qui2Me4NAc	Qui2Me4NBut	Qui2N6S	Qui2NAlaAc4NAlaAc	Qui2NBut4NBut	Qui2S3NBut	Qui3N	Qui3NAc	Qui3NAc-ol	Qui3NAlaAc	Qui3NBut	Qui3NFo	Qui3NSerAc	Qui3NThrAc	Qui4CN	Qui4N	Qui4NAc	Qui4NAlaAc	Qui4NAlaBut	Qui4NAlaLac	Qui4NAspAc	Qui4NBut	Qui4NButAla	Qui4NFo	Qui4NGlyAc	Qui4NHSerAc	Qui4NHSerBut	Qui4NMe	Qui4NSerAc	Qui6S	QuiN	QuiNAc	QuiNAc-ol	QuiNAc1Gro	QuiNAc1Gro4N	QuiNAc1Me4NAc	QuiNAc1N	QuiNAc2Ac4Ac	QuiNAc3Ac4Ac	QuiNAc3NAc	QuiNAc4Ac	QuiNAc4Me	QuiNAc4N	QuiNAc4NAc	QuiNAc4NBut	QuiNAc4NButGro	QuiNAc4NGroA	QuiNAc4NHex	QuiNAcGro	QuiNAcN	QuiNAcNAlaAc	QuiNAcNAm	QuiNAcNAspAc	QuiNAcNBut	QuiNAcOAc	QuiNAcOBut	QuiNAcOMe	QuiNAcOP	QuiNAcOPGro	QuiNAcPGro	QuiNAla	QuiNAlaAc	QuiNAlaAcGro	QuiNAlaButGro	QuiNAspAc	QuiNBut	QuiNButAla	QuiNButOMe	QuiNFo	QuiNGlyAc	QuiNHseGro	QuiNLac	QuiNMal	QuiNMe3Lac	QuiNSerAc	QuiNThrAc	QuiOMe	QuiOMeN	Rha	Rha-ol	Rha1Dco	Rha1EtN	Rha1Fer	Rha1Gro	Rha1Gro3Me	Rha1Gro3PEtN	Rha1Me	Rha1N	Rha1P	Rha1PP	Rha1Prop	Rha2Ac	Rha2Ac3Ac	Rha2Ac3Ac4Ac	Rha2Ac3Lac	Rha2Ac3Me	Rha2Ac3PCho	Rha2Ac4Ac	Rha2Cl	Rha2Gro	Rha2Me	Rha2Me3Me	Rha2Me3Me4Me	Rha2Me4Bz	Rha2Me4Me	Rha2PCho	Rha2S	Rha2S3S4S	Rha3Ac	Rha3Ac4Ac	Rha3Lac	Rha3Me	Rha3Me4Me	Rha3PEtN	Rha3PEtN4Ac	Rha3PGro	Rha3PMe	Rha3Pyr	Rha3S	Rha4Ac	Rha4Me	Rha4PGro	RhaCMe	RhaGro	RhaGroA	RhaNAc	RhaNAc3NAc	RhaNAc3NAc4Ac	RhaNAc3NFo	RhaNAcNBut	RhaNAcOAc	RhaNPro	RhaOAc	RhaOAcOLac	RhaOAcOMe	RhaOBut	RhaOLac	RhaOMe	RhaOMeCMeNLac	RhaOMeCMeOFo	RhaOP	RhaOPEtN	RhaOPGro	RhaOPOMe	RhaOPyr	RhaOS	RhaPGro	Rhaf	Rib	Rib-ol	Rib1N5PP-ol	Rib1P	Rib1P-ol	Rib1P2Ala3Ala4Ala-ol	Rib2Ac3Ac4Ac	Rib2Ac5P-ol	Rib2Ala5P-ol	Rib3Ac5P-ol	Rib3P-ol	Rib4Ac5P-ol	Rib5P	Rib5P-ol	Rib5PP-ol	RibOAc	RibOAcOP-ol	RibOP-ol	RibOPEtN-ol	RibOPGro-ol	RibOPPGro-ol	RibPGro-ol	Ribf	Ribf-uronic	Ribf1N	Ribf1N2P	Ribf1N5P	Ribf2Ac	Ribf3Ac	Ribf5Ac	Ribf5P	RibfOAc	Sed	Sedf	Sia	Sor	Sorf	Suc	Sug	Sug2Ac	Sug2Ac3Ac	Sug2Ac3Ac4Ac	Sug2Ac5Me	Sug5Ac7Pyr	Sug5Ac7Pyr8Ac	SugOAc	Sugf	Tag	Tagf	Tal	TalA	TalNAc-ol	Thre-ol	Thre-onic	Tyv	Tyv1PP	Tyv2Me	VioNAc	Xluf	Xluf1Me	Xluf3Me	XlufOMe	Xyl	Xyl-ol	Xyl-onic	Xyl1Me	Xyl1N	Xyl1N-ol	Xyl1N2Me-ol	Xyl1P	Xyl1PP	Xyl2Ac	Xyl2Ac3Ac	Xyl2Ac3Ac4Ac	Xyl2F	Xyl2Me	Xyl2Me3Me	Xyl2Me4Me	Xyl2NAc	Xyl2P	Xyl2P-ol	Xyl2S	Xyl3Ac	Xyl3Me	Xyl4Ac	Xyl4Me	Xyl4N	Xyl4S	XylOAc	XylOBz	XylOMe	Xylf	Xylf2Me3Me5Me	Yer	YerOAc	a1-1	a1-11	a1-2	a1-3	a1-4	a1-5	a1-6	a1-7	a1-8	a1-9	a1-?	a2-1	a2-11	a2-2	a2-3	a2-4	a2-5	a2-6	a2-7	a2-8	a2-9	a2-?	a3-2	a3-4	a4-1	a6-1	a6-2	a6-3	a6-6	b1-1	b1-2	b1-3	b1-4	b1-5	b1-6	b1-7	b1-8	b1-9	b1-?	b2-1	b2-2	b2-3	b2-4	b2-5	b2-6	b2-7	b2-8	b3-1	b3-3	b4-1	b4-2	b6-1	b6-2	b6-3	bond	dHex	{Fuc	{Gal	{GlcNAc	{HexNAc	{Man	{Neu5Ac	{Neu5Gc	}Fuc	}Gal	}GlcNAc	}Man	}Neu5Ac	}Neu5Gc	}{Fuc	}{Gal	}{GlcNAc	}{Man	}{Neu5Ac	}{Neu5Gc	Fuc(a1-3)GlcNAc	GalNAc(a1-4)GlcNAcA	GlcN(b1-7)Kdo	GlcN4P(b1-6)GlcN1P	GlcNAc(b1-4)GlcNAc	GlcNAcA(a1-4)Kdo	Kdo(a2-4)Kdo	Kdo(a2-5)Kdo	Kdo(a2-6)GlcN4P	Man(a1-2)Man	Man(a1-3)Man	Man(a1-6)Man	Man(b1-4)GlcNAc	Xyl(b1-2)Man
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GalNAc(a1-4)GlcNAcA(a1-4)[GlcN(b1-7)]Kdo(a2-5)[Kdo(a2-4)]Kdo(a2-6)GlcN4P(b1-6)GlcN1P	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	10.0	2.0	4.0	1.866667	0.382222	3.0	0.0	4.0	4.0	-1.449275e-02	0.239560	0.044684	0.615385	0.287575	0.234359	0.257668	0.000274	0.350000	0.172840	0.255611	0.003247	0.615385	0.239560	0.044684	0.307692	0.076923	0.169545	0.006240	0.615385	0.239560	0.044684	6.616667	3.563492	5.083122	0.950051	66.992537	28.248894	47.236515	150.711681	4.0	15.0	15.0	0.013600	-2.688625	15.0	14.0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0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#using graphs, you can easily check whether two glycans are the same - even if they use different bracket notations!
from glycowork.motif.graph import compare_glycans
print(compare_glycans('Man(a1-3)[Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc',
                     'Man(a1-6)[Man(a1-3)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc'))
print(compare_glycans('Man(a1-3)[Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc',
                     'Man(a1-6)[Man(a1-3)]Man(b1-4)GlcNAc(b1-4)GlcNAc'))

#or you could find the terminal structures of a glycan
from glycowork.motif.annotate import get_terminal_structures
print("\nTerminal structures:")
print(get_terminal_structures('Man(a1-3)[Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc'))

True
False

Terminal structures:
['Man(a1-3)', 'Man(a1-6)', 'Fuc(a1-6)']

#given a composition, find matching glycan structures in sugarbase; can be set to species-specific structures
from glycowork.motif.tokenization import compositions_to_structures
print(compositions_to_structures([{'Hex':3, 'HexNAc':4}], reducing_end = 'GlcNAc'))

#or we could calculate the mass of this composition
from glycowork.motif.tokenization import composition_to_mass
print("\nMass of the composition Hex3HexNAc4")
print(composition_to_mass({'Hex':3, 'HexNAc':4}))

0 compositions could not be matched. Run with verbose = True to see which compositions.
                                              glycan  abundance
0  GalNAc(b1-4)GlcNAc(b1-2)Man(a1-3)[Man(a1-6)]Ma...          0
1  GlcNAc(?1-?)Man(a1-3)[GlcNAc(?1-?)Man(a1-6)]Ma...          0
2  GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-6)Man(a1-6)]Ma...          0
3  GlcNAc(b1-4)Man(a1-3)[GlcNAc(b1-6)Man(a1-6)]Ma...          0
4  GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-2)Man(a1-6)]Ma...          0
5  GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-2)Man(a1-6)][G...          0
6  GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-2)[GlcNAc(b1-4...          0
7  GlcNAc(b1-2)[GlcNAc(b1-4)]Man(a1-3)[GlcNAc(b1-...          0
8  GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-4)][Man(a1-6)]...          0
9  GlcNAc(b1-4)Man(a1-3)[GlcNAc(b1-2)Man(a1-6)]Ma...          0

Mass of the composition Hex3HexNAc4
1316.4865545999999