i_canvas_aaaC_Cnt
i_canvas_aaCH_Cnt
i_canvas_aaN_Cnt
i_canvas_aaNH_Cnt
i_canvas_aaO_Cnt
i_canvas_aasC_Cnt
i_canvas_aaS_Cnt
i_canvas_aaSe_Cnt
i_canvas_aasN_Cnt
i_canvas_aOm_Cnt
i_canvas_ChiralCenterCount
i_canvas_ChiralCenterCountAllPossible
i_canvas_daaN_Cnt
i_canvas_dCH2_Cnt
i_canvas_ddC_Cnt
i_canvas_ddsAs_Cnt
i_canvas_ddsN_Cnt
i_canvas_ddsP_Cnt
i_canvas_ddssS_Cnt
i_canvas_ddssSe_Cnt
i_canvas_dNH_Cnt
i_canvas_dO_Cnt
i_canvas_dsCH_Cnt
i_canvas_dS_Cnt
i_canvas_dSe_Cnt
i_canvas_dsN_Cnt
i_canvas_dssC_Cnt
i_canvas_dsssAs_Cnt
i_canvas_dssS_Cnt
i_canvas_dssSe_Cnt
i_canvas_dsssP_Cnt
i_canvas_HBA
i_canvas_HBD
i_canvas_HeavyAtomCount
i_canvas_RB
i_canvas_RingCount
i_canvas_sAsH2_Cnt
i_canvas_sBH2_Cnt
i_canvas_sBr_Cnt
i_canvas_sCH3_Cnt
i_canvas_sCl_Cnt
i_canvas_sF_Cnt
i_canvas_sGeH3_Cnt
i_canvas_sI_Cnt
i_canvas_sLi_Cnt
i_canvas_Sm_Cnt
i_canvas_sNH2_Cnt
i_canvas_sNH3_Cnt
i_canvas_sOH_Cnt
i_canvas_sOm_Cnt
i_canvas_sPbH3_Cnt
i_canvas_sPH2_Cnt
i_canvas_ssAsH_Cnt
i_canvas_ssBe_Cnt
i_canvas_ssBH_Cnt
i_canvas_ssCH2_Cnt
i_canvas_sSeH_Cnt
i_canvas_ssGeH2_Cnt
i_canvas_sSH_Cnt
i_canvas_sSiH3_Cnt
i_canvas_ssNH2_Cnt
i_canvas_sSnH3_Cnt
i_canvas_ssNH_Cnt
i_canvas_ssO_Cnt
i_canvas_ssPbH2_Cnt
i_canvas_ssPH_Cnt
i_canvas_sssAs_Cnt
i_canvas_sssB_Cnt
i_canvas_sssCH_Cnt
i_canvas_ssS_Cnt
i_canvas_ssSe_Cnt
i_canvas_sssGeH_Cnt
i_canvas_ssSiH2_Cnt
i_canvas_sssN_Cnt
i_canvas_ssSnH2_Cnt
i_canvas_sssNH_Cnt
i_canvas_sssPbH_Cnt
i_canvas_sssP_Cnt
i_canvas_ssssBem_Cnt
i_canvas_ssssBm_Cnt
i_canvas_ssssC_Cnt
i_canvas_ssssGe_Cnt
i_canvas_sssSiH_Cnt
i_canvas_ssssN_Cnt
i_canvas_sssSnH_Cnt
i_canvas_ssssPb_Cnt
i_canvas_sssssAs_Cnt
i_canvas_ssssSi_Cnt
i_canvas_ssssSn_Cnt
i_canvas_sssssP_Cnt
i_canvas_ssssssS_Cnt
i_canvas_ssssssSe_Cnt
i_canvas_tCH_Cnt
i_canvas_tN_Cnt
i_canvas_tsC_Cnt
r_canvas_AlogP
r_canvas_Estate
r_canvas_MR
r_canvas_MW
r_canvas_Polar
r_canvas_PSA
i_desc_Atom_Count
i_desc_Atoms_in_Ring_System
i_desc_Bond_Count
i_desc_Bonds_in_Ring_System
i_desc_Centralization
i_desc_Chirality_count
i_desc_Cyclomatic_number
i_desc_Eccentric_connectivity
i_desc_Eccentricity
i_desc_First_Zagreb
i_desc_Gutman_Molecular_Topological
i_desc_Number_of_ring_systems
i_desc_Polarity
i_desc_Quadratic
i_desc_Ramification
i_desc_Ring_bridge_count
i_desc_Ring_Count_10
i_desc_Ring_Count_11
i_desc_Ring_Count_12
i_desc_Ring_Count_13
i_desc_Ring_Count_14
i_desc_Ring_Count_15
i_desc_Ring_Count_16
i_desc_Ring_Count_17
i_desc_Ring_Count_18
i_desc_Ring_Count_19
i_desc_Ring_Count_20
i_desc_Ring_Count_3
i_desc_Ring_Count_4
i_desc_Ring_Count_5
i_desc_Ring_Count_6
i_desc_Ring_Count_7
i_desc_Ring_Count_8
i_desc_Ring_Count_9
i_desc_Ring_perimeter
i_desc_Schultz_Molecular_Topological
i_desc_Second_Zagreb
i_desc_Sum_of_topological_distances_between_Br..Br
i_desc_Sum_of_topological_distances_between_Br..I
i_desc_Sum_of_topological_distances_between_Cl..Br
i_desc_Sum_of_topological_distances_between_Cl..Cl
i_desc_Sum_of_topological_distances_between_Cl..I
i_desc_Sum_of_topological_distances_between_F..Br
i_desc_Sum_of_topological_distances_between_F..Cl
i_desc_Sum_of_topological_distances_between_F..F
i_desc_Sum_of_topological_distances_between_F..I
i_desc_Sum_of_topological_distances_between_I..I
i_desc_Sum_of_topological_distances_between_N..Br
i_desc_Sum_of_topological_distances_between_N..Cl
i_desc_Sum_of_topological_distances_between_N..F
i_desc_Sum_of_topological_distances_between_N..I
i_desc_Sum_of_topological_distances_between_N..N
i_desc_Sum_of_topological_distances_between_N..O
i_desc_Sum_of_topological_distances_between_N..P
i_desc_Sum_of_topological_distances_between_N..S
i_desc_Sum_of_topological_distances_between_O..Br
i_desc_Sum_of_topological_distances_between_O..Cl
i_desc_Sum_of_topological_distances_between_O..F
i_desc_Sum_of_topological_distances_between_O..I
i_desc_Sum_of_topological_distances_between_O..O
i_desc_Sum_of_topological_distances_between_O..P
i_desc_Sum_of_topological_distances_between_O..S
i_desc_Sum_of_topological_distances_between_P..Br
i_desc_Sum_of_topological_distances_between_P..Cl
i_desc_Sum_of_topological_distances_between_P..F
i_desc_Sum_of_topological_distances_between_P..I
i_desc_Sum_of_topological_distances_between_P..P
i_desc_Sum_of_topological_distances_between_S..Br
i_desc_Sum_of_topological_distances_between_S..Cl
i_desc_Sum_of_topological_distances_between_S..F
i_desc_Sum_of_topological_distances_between_S..I
i_desc_Sum_of_topological_distances_between_S..P
i_desc_Sum_of_topological_distances_between_S..S
i_desc_Topological_diameter
i_desc_Topological_radius
i_desc_Total_ring_size
i_desc_Unipolarity
i_desc_Variation
i_desc_Wiener
r_desc_1-path_Kier_alpha-modified_shape_index
r_desc_2-path_Kier_alpha-modified_shape_index
r_desc_3-path_Kier_alpha-modified_shape_index
r_desc_ALOGP1
r_desc_ALOGP10
r_desc_ALOGP2
r_desc_ALOGP3
r_desc_ALOGP4
r_desc_ALOGP5
r_desc_ALOGP6
r_desc_ALOGP7
r_desc_ALOGP8
r_desc_ALOGP9
r_desc_Average_connectivity_index_chi-0
r_desc_Average_connectivity_index_chi-1
r_desc_Average_connectivity_index_chi-2
r_desc_Average_connectivity_index_chi-3
r_desc_Average_connectivity_index_chi-4
r_desc_Average_connectivity_index_chi-5
r_desc_Average_eccentricity
r_desc_Average_valence_connectivity_index_chi-0
r_desc_Average_valence_connectivity_index_chi-1
r_desc_Average_valence_connectivity_index_chi-2
r_desc_Average_valence_connectivity_index_chi-3
r_desc_Average_valence_connectivity_index_chi-4
r_desc_Average_valence_connectivity_index_chi-5
r_desc_Average_vertex_distance_degree
r_desc_Balaban_centric
r_desc_Balaban_distance_connectivity_index
r_desc_Balaban-type_index_from_electronegativity_weighted_distance_matrix
r_desc_Balaban-type_index_from_mass_weighted_distance_matrix
r_desc_Balaban-type_index_from_polarizability_weighted_distance_matrix
r_desc_Balaban-type_index_from_van_der_waals_weighted_distance_matrix
r_desc_Balaban-type_index_from_Z_weighted_distance_matrix_-_Barysz_matrix
r_desc_Connectivity_chi-1_[Randic_connectivity]
r_desc_Connectivity_index_chi-0
r_desc_Connectivity_index_chi-2
r_desc_Connectivity_index_chi-3
r_desc_Connectivity_index_chi-4
r_desc_Connectivity_index_chi-5
r_desc_Eccentric
r_desc_E-state_topological_parameter
r_desc_First_Mohar
r_desc_First_Zagreb_index_by_valence_vertex_degrees
r_desc_Global_topological_charge
r_desc_Gutman_MTI_by_valence_vertex_degrees
r_desc_Harary
r_desc_Hyper-distance-path_index
r_desc_Kier_benzene-likeliness_index
r_desc_Kier_flexibility
r_desc_Kier_Hall_electronegativity
r_desc_Log_of_product_of_row_sums
r_desc_Lopping_centric
r_desc_Maximal_electrotopological_negative_variation
r_desc_Maximal_electrotopological_positive_variation
r_desc_Mean_Distance_Degree_Deviation
r_desc_Mean_Square_Distance_Balaban
r_desc_Mean_topological_charge_index_of_order_1
r_desc_Mean_topological_charge_index_of_order_10
r_desc_Mean_topological_charge_index_of_order_2
r_desc_Mean_topological_charge_index_of_order_3
r_desc_Mean_topological_charge_index_of_order_4
r_desc_Mean_topological_charge_index_of_order_5
r_desc_Mean_topological_charge_index_of_order_6
r_desc_Mean_topological_charge_index_of_order_7
r_desc_Mean_topological_charge_index_of_order_8
r_desc_Mean_topological_charge_index_of_order_9
r_desc_Mean_Wiener
r_desc_Modified_Randic_connectivity
r_desc_Molecular_electrotopological_variation
r_desc_Molecule_cyclized_degree
r_desc_MR1
r_desc_MR2
r_desc_MR3
r_desc_MR4
r_desc_MR5
r_desc_MR6
r_desc_MR7
r_desc_MR8
r_desc_Narumi_Geometric_Topological
r_desc_Narumi_Harmonic_Topological
r_desc_Narumi_Simple_Topological
r_desc_Normalized_number_of_ring_systems
r_desc_path/walk_2_-_Randic_shape_index
r_desc_path/walk_3_-_Randic_shape_index
r_desc_path/walk_4_-_Randic_shape_index
r_desc_path/walk_5_-_Randic_shape_index
r_desc_PEOE1
r_desc_PEOE10
r_desc_PEOE11
r_desc_PEOE12
r_desc_PEOE13
r_desc_PEOE14
r_desc_PEOE2
r_desc_PEOE3
r_desc_PEOE4
r_desc_PEOE5
r_desc_PEOE6
r_desc_PEOE7
r_desc_PEOE8
r_desc_PEOE9
r_desc_Petitjean_2D_shape
r_desc_Pogliani
r_desc_Quasi_Wiener
r_desc_Radial_centric
r_desc_reciprocal_distance_Randic-type_index
r_desc_reciprocal_distance_square_Randic-type_index
r_desc_Reciprocal_hyper-distance-path_index
r_desc_Ring_complexity_index
r_desc_Ring_Fusion_degree
r_desc_Ring_Fusion_density
r_desc_Schultz_Molecular_Topological_by_valence_vertex_degrees
r_desc_Second_Mohar
r_desc_Second_Zagreb_index_by_valence_vertex_degrees
r_desc_Solvation_connectivity_index_chi-0
r_desc_Solvation_connectivity_index_chi-1
r_desc_Solvation_connectivity_index_chi-2
r_desc_Solvation_connectivity_index_chi-3
r_desc_Solvation_connectivity_index_chi-4
r_desc_Solvation_connectivity_index_chi-5
r_desc_Spanning_tree_number
r_desc_Square_reciprocal_distance_sum
r_desc_Superpendentic
r_desc_Topological_charge_index_of_order_1
r_desc_Topological_charge_index_of_order_10
r_desc_Topological_charge_index_of_order_2
r_desc_Topological_charge_index_of_order_3
r_desc_Topological_charge_index_of_order_4
r_desc_Topological_charge_index_of_order_5
r_desc_Topological_charge_index_of_order_6
r_desc_Topological_charge_index_of_order_7
r_desc_Topological_charge_index_of_order_8
r_desc_Topological_charge_index_of_order_9
r_desc_Total_structure_connectivity
r_desc_Valence_connectivity_index_chi-0
r_desc_Valence_connectivity_index_chi-1
r_desc_Valence_connectivity_index_chi-2
r_desc_Valence_connectivity_index_chi-3
r_desc_Valence_connectivity_index_chi-4
r_desc_Valence_connectivity_index_chi-5
r_desc_Van_der_Waals_surface_area
r_desc_Wiener-type_index_from_electronegativity_weighted_distance_matrix
r_desc_Wiener-type_index_from_mass_weighted_distance_matrix
r_desc_Wiener-type_index_from_polarizability_weighted_distance_matrix
r_desc_Wiener-type_index_from_van_der_waals_weighted_distance_matrix
r_desc_Wiener-type_index_from_Z_weighted_distance_matrix_-_Barysz_matrix
r_desc_Xu
i_ligfilter_1,2-Dicarbonyls
i_ligfilter_Acceptor_groups
i_ligfilter_Acetylhydrazides
i_ligfilter_Acidic_hydrogens
i_ligfilter_Actinide_series
i_ligfilter_Acyl_halides
i_ligfilter_Alcohols
i_ligfilter_Aldehydes
i_ligfilter_Aliphatic_carbons
i_ligfilter_Aliphatic_esters
i_ligfilter_Aliphatic_ketones
i_ligfilter_Aliphatic_thioesters
i_ligfilter_Alkali_metals
i_ligfilter_Alkaline-earth_metals
i_ligfilter_Alkyl_halides
i_ligfilter_Alkyl_halides_wo_fluorine
i_ligfilter_Alkyl_sulfonates
i_ligfilter_Amide_hydrogens
i_ligfilter_Amidines
i_ligfilter_Amine_or_amide_hydrogens
i_ligfilter_Anhydrides
i_ligfilter_Aromatic_basic_nitrogens
i_ligfilter_Aromatic_carbons
i_ligfilter_Aromatic_carboxylate_bioisosteres
i_ligfilter_Aromatic_N-oxides
i_ligfilter_Azides
i_ligfilter_Aziridines
i_ligfilter_B
i_ligfilter_beta-Heterosubstituted_carbonyls
i_ligfilter_Br
i_ligfilter_C
i_ligfilter_Carbodiimides
i_ligfilter_Carbon_Thiols
i_ligfilter_Carbonyls
i_ligfilter_Carboxylic_acids_or_carboxylates
i_ligfilter_Catch_for_R-CN4
i_ligfilter_Catch_for_uncharged_guanine_H
i_ligfilter_Charged_2-aminopyridines
i_ligfilter_Charged_2-nitrophenols
i_ligfilter_Charged_3,5-nitrophenols
i_ligfilter_Charged_4-aminopyridines
i_ligfilter_Charged_4-methoxypyridines
i_ligfilter_Charged_4-nitrophenols
i_ligfilter_Charged_acceptor_groups
i_ligfilter_Charged_alkylthiols
i_ligfilter_Charged_amidines
i_ligfilter_Charged_amines
i_ligfilter_Charged_anilines
i_ligfilter_Charged_carboxylic_acids
i_ligfilter_Charged_C-PO3-
i_ligfilter_Charged_dialkyl_anilines
i_ligfilter_Charged_diaminobenzenes
i_ligfilter_Charged_donor_groups
i_ligfilter_Charged_enamines
i_ligfilter_Charged_guanidines
i_ligfilter_Charged_halophosphoric_acids
i_ligfilter_Charged_hydroxamic_acids
i_ligfilter_Charged_imidazoles
i_ligfilter_Charged_imines
i_ligfilter_Charged_NH-imidazoles
i_ligfilter_Charged_N-O
i_ligfilter_Charged_O-PO3
i_ligfilter_Charged_phosphonamides
i_ligfilter_Charged_phosphonic_acids
i_ligfilter_Charged_phosphoric_acids
i_ligfilter_Charged_phosphorylamides
i_ligfilter_Charged_pyridines
i_ligfilter_Charged_sulfenic_acids
i_ligfilter_Charged_sulfonamides
i_ligfilter_Charged_sulfonic_acids
i_ligfilter_Charged_sulfuric_acids
i_ligfilter_Charged_tetrazoles
i_ligfilter_Cl
i_ligfilter_Diazoniums
i_ligfilter_Diazos
i_ligfilter_Disulfides
i_ligfilter_Divalent_oxygens
i_ligfilter_Donor_groups
i_ligfilter_Epoxides
i_ligfilter_Ethers
i_ligfilter_F
i_ligfilter_Fe
i_ligfilter_Formates
i_ligfilter_Guanidines
i_ligfilter_H
i_ligfilter_Halopyrimidines
i_ligfilter_Heteroaromatic_atoms
i_ligfilter_H-N
i_ligfilter_H-O
i_ligfilter_Hydroxamates
i_ligfilter_I
i_ligfilter_Imines
i_ligfilter_Imines_hydrogens
i_ligfilter_Imines_N_donors
i_ligfilter_Imines_NH
i_ligfilter_Iron_binding_groups
i_ligfilter_Isocyanates
i_ligfilter_Isonitriles
i_ligfilter_Isothiocyanates
i_ligfilter_Lanthanide_series
i_ligfilter_Metals
i_ligfilter_Michael_acceptors
i_ligfilter_N
i_ligfilter_Neutral_acceptor_groups
i_ligfilter_Neutral_amines
i_ligfilter_Neutral_carbonyls
i_ligfilter_Neutral_donor_groups
i_ligfilter_Neutral_halophosphoric_acids
i_ligfilter_Neutral_imidazoles
i_ligfilter_Neutral_N-O
i_ligfilter_Neutral_NR3-O
i_ligfilter_Neutral_P(=O)2-R2
i_ligfilter_Neutral_P=O-R3
i_ligfilter_Neutral_pyridines
i_ligfilter_Neutral_sulfenes
i_ligfilter_Neutral_sulfones
i_ligfilter_Nitriles
i_ligfilter_Nitroalkanes
i_ligfilter_Nitros
i_ligfilter_Noble_gases
i_ligfilter_N-Pyrrole_H
i_ligfilter_Num_aliphatic_rings
i_ligfilter_Num_aromatic_rings
i_ligfilter_Num_atoms
i_ligfilter_Num_chiral_centers
i_ligfilter_Num_heavy_atoms
i_ligfilter_Num_heteroaromatic_rings
i_ligfilter_Num_molecules
i_ligfilter_Num_negative_atoms
i_ligfilter_Num_positive_atoms
i_ligfilter_Num_residues
i_ligfilter_Num_rings
i_ligfilter_Num_rotatable_bonds
i_ligfilter_O
i_ligfilter_Other_metals
i_ligfilter_P
i_ligfilter_Perhalomethylketones
i_ligfilter_Peroxides
i_ligfilter_Phosphines
i_ligfilter_Phosphinyl_halides
i_ligfilter_Phosphonate_esters
i_ligfilter_Phosphonyl_halides
i_ligfilter_P=O
i_ligfilter_Reactive_groups
i_ligfilter_R-N-S-R
i_ligfilter_R-S-O-R
i_ligfilter_S
i_ligfilter_Si
i_ligfilter_Silyl_enol_ethers
i_ligfilter_S=O
i_ligfilter_Sulfenyl_halides
i_ligfilter_Sulfinyl_halides
i_ligfilter_Sulfonyl_halides
i_ligfilter_Sulphonate_esters
i_ligfilter_t-Butyls
i_ligfilter_Tertiary_amines_or_amides
i_ligfilter_Tetrazoles
i_ligfilter_Thiols
i_ligfilter_Thiones
i_ligfilter_Total_charge
i_ligfilter_Toxic_nonmetals
i_ligfilter_Transition_metals
i_ligfilter_Tribromomethyls
i_ligfilter_Trichloromethyls
i_ligfilter_Trifluoromethyls
i_ligfilter_Triiodomethyls
r_ligfilter_Molecular_weight
r_ligfilter_Percent_helix
r_ligfilter_Percent_loop
r_ligfilter_Percent_strand