Figures.zip
Figures
.DS_Store
6.1 kB
._.DS_Store
4.1 kB
._cluster_energies_ref
4.1 kB
._nmr_scoring_ref
4.1 kB
cluster_energies_ref
._cluster_formation_energies_hist.pdf
4.1 kB
._cluster_formation_energies_hist_norm.pdf
4.1 kB
._energies_C4_pistack.pdf
4.1 kB
._energies_Cl25_halogen_bond.pdf
4.1 kB
._energies_Cl43_halogen_bond.pdf
4.1 kB
._energies_N12_hbond_acceptor.pdf
4.1 kB
._energies_N12_pistack.pdf
4.1 kB
._energies_N17_hbond_acceptor.pdf
4.1 kB
._energies_N20_hbond_acceptor.pdf
4.1 kB
._energies_N28_hbond_acceptor.pdf
4.1 kB
._energies_N28_pistack.pdf
4.1 kB
._energies_N31_hbond_acceptor.pdf
4.1 kB
._energies_O1_hbond_acceptor.pdf
4.1 kB
._energies_O38_hbond_acceptor.pdf
4.1 kB
._energies_O3_hbond_acceptor.pdf
4.1 kB
._energies_O42_hbond_acceptor.pdf
4.1 kB
._energies_O44_hbond_acceptor.pdf
4.1 kB
._energies_dihedral_C18-C19.pdf
4.1 kB
._energies_dihedral_C2-C11.pdf
4.1 kB
._energies_dihedral_C26-C27.pdf
4.1 kB
._energies_dihedral_C33-C41.pdf
4.1 kB
._energies_dihedral_C36-C37.pdf
4.1 kB
._energies_dihedral_C41-O42.pdf
4.1 kB
._energies_dihedral_N17-C6.pdf
4.1 kB
._energies_dihedral_N28-C36.pdf
4.1 kB
._energies_dihedral_aroms.pdf
4.1 kB
._energies_hydrogen_bond_COOH.pdf
4.1 kB
cluster_formation_energies_hist.pdf
14.9 kB
cluster_formation_energies_hist_norm.pdf
15.0 kB
energies_C4_pistack.pdf
12.8 kB
energies_Cl25_halogen_bond.pdf
13.7 kB
energies_Cl43_halogen_bond.pdf
12.9 kB
energies_N12_hbond_acceptor.pdf
13.0 kB
energies_N12_pistack.pdf
12.8 kB
energies_N17_hbond_acceptor.pdf
12.8 kB
energies_N20_hbond_acceptor.pdf
12.8 kB
energies_N28_hbond_acceptor.pdf
12.8 kB
energies_N28_pistack.pdf
12.8 kB
energies_N31_hbond_acceptor.pdf
13.6 kB
energies_O1_hbond_acceptor.pdf
12.8 kB
energies_O38_hbond_acceptor.pdf
13.4 kB
energies_O3_hbond_acceptor.pdf
12.8 kB
energies_O42_hbond_acceptor.pdf
12.8 kB
energies_O44_hbond_acceptor.pdf
13.5 kB
energies_dihedral_C18-C19.pdf
19.3 kB
energies_dihedral_C2-C11.pdf
24.0 kB
energies_dihedral_C26-C27.pdf
24.1 kB
energies_dihedral_C33-C41.pdf
21.8 kB
energies_dihedral_C36-C37.pdf
25.6 kB
energies_dihedral_C41-O42.pdf
20.4 kB
energies_dihedral_N17-C6.pdf
25.6 kB
energies_dihedral_N28-C36.pdf
21.1 kB
energies_dihedral_aroms.pdf
25.9 kB
energies_hydrogen_bond_COOH.pdf
16.5 kB
nmr_scoring_ref
._C1c_1_scores.pdf
4.1 kB
._C1c_1_scores_log.pdf
4.1 kB
._C1c_2_scores.pdf
4.1 kB
._C1c_2_scores_log.pdf
4.1 kB
._C1c_3_scores.pdf
4.1 kB
._C1c_3_scores_log.pdf
4.1 kB
._C1c_4_scores.pdf
4.1 kB
._C1c_4_scores_log.pdf
4.1 kB
._C1c_5_scores.pdf
4.1 kB
._C1c_5_scores_log.pdf
4.1 kB
._C2b_1_scores.pdf
4.1 kB
._C2b_1_scores_log.pdf
4.1 kB
._C2b_2_scores.pdf
4.1 kB
._C2b_2_scores_log.pdf
4.1 kB
._C2b_3_scores.pdf
4.1 kB
._C2b_3_scores_log.pdf
4.1 kB
._C2b_4_scores.pdf
4.1 kB
._C2b_4_scores_log.pdf
4.1 kB
._C2b_5_scores.pdf
4.1 kB
._C2b_5_scores_log.pdf
4.1 kB
._Compound_1_non_zw_1_scores.pdf
4.1 kB
._Compound_1_non_zw_1_scores_log.pdf
4.1 kB
._Compound_1_non_zw_2_scores.pdf
4.1 kB
._Compound_1_non_zw_2_scores_log.pdf
4.1 kB
._Compound_1_non_zw_3_scores.pdf
4.1 kB
._Compound_1_non_zw_3_scores_log.pdf
4.1 kB
._Compound_1_non_zw_4_scores.pdf
4.1 kB
._Compound_1_non_zw_4_scores_log.pdf
4.1 kB
._Compound_1_non_zw_5_scores.pdf
4.1 kB
._Compound_1_non_zw_5_scores_log.pdf
4.1 kB
C1c_1_scores.pdf
11.6 kB
C1c_1_scores_log.pdf
12.0 kB
C1c_2_scores.pdf
11.6 kB
C1c_2_scores_log.pdf
12.0 kB
C1c_3_scores.pdf
11.5 kB
C1c_3_scores_log.pdf
12.0 kB
C1c_4_scores.pdf
11.6 kB
C1c_4_scores_log.pdf
12.0 kB
C1c_5_scores.pdf
11.6 kB
C1c_5_scores_log.pdf
12.0 kB
C2b_1_scores.pdf
11.6 kB
C2b_1_scores_log.pdf
12.0 kB
C2b_2_scores.pdf
11.6 kB
C2b_2_scores_log.pdf
12.0 kB
C2b_3_scores.pdf
11.6 kB
C2b_3_scores_log.pdf
12.0 kB
C2b_4_scores.pdf
11.6 kB
C2b_4_scores_log.pdf
12.0 kB
C2b_5_scores.pdf
11.6 kB
C2b_5_scores_log.pdf
12.0 kB
Compound_1_non_zw_1_scores.pdf
11.6 kB
Compound_1_non_zw_1_scores_log.pdf
12.0 kB
Compound_1_non_zw_2_scores.pdf
11.6 kB
Compound_1_non_zw_2_scores_log.pdf
12.0 kB
Compound_1_non_zw_3_scores.pdf
11.6 kB
Compound_1_non_zw_3_scores_log.pdf
12.0 kB
Compound_1_non_zw_4_scores.pdf
11.6 kB
Compound_1_non_zw_4_scores_log.pdf
11.9 kB
Compound_1_non_zw_5_scores.pdf
11.6 kB
Compound_1_non_zw_5_scores_log.pdf
12.0 kB
__MACOSX
._Figures
170 Bytes
Figures
._.DS_Store
170 Bytes
._cluster_energies_ref
170 Bytes
._nmr_scoring_ref
170 Bytes
cluster_energies_ref
._cluster_formation_energies_hist.pdf
170 Bytes
._cluster_formation_energies_hist_norm.pdf
170 Bytes
._energies_C4_pistack.pdf
170 Bytes
._energies_Cl25_halogen_bond.pdf
170 Bytes
._energies_Cl43_halogen_bond.pdf
170 Bytes
._energies_N12_hbond_acceptor.pdf
170 Bytes
._energies_N12_pistack.pdf
170 Bytes
._energies_N17_hbond_acceptor.pdf
170 Bytes
._energies_N20_hbond_acceptor.pdf
170 Bytes
._energies_N28_hbond_acceptor.pdf
170 Bytes
._energies_N28_pistack.pdf
170 Bytes
._energies_N31_hbond_acceptor.pdf
170 Bytes
._energies_O1_hbond_acceptor.pdf
170 Bytes
._energies_O38_hbond_acceptor.pdf
170 Bytes
._energies_O3_hbond_acceptor.pdf
170 Bytes
._energies_O42_hbond_acceptor.pdf
170 Bytes
._energies_O44_hbond_acceptor.pdf
170 Bytes
._energies_dihedral_C18-C19.pdf
170 Bytes
._energies_dihedral_C2-C11.pdf
170 Bytes
._energies_dihedral_C26-C27.pdf
170 Bytes
._energies_dihedral_C33-C41.pdf
170 Bytes
._energies_dihedral_C36-C37.pdf
170 Bytes
._energies_dihedral_C41-O42.pdf
170 Bytes
._energies_dihedral_N17-C6.pdf
170 Bytes
._energies_dihedral_N28-C36.pdf
170 Bytes
._energies_dihedral_aroms.pdf
170 Bytes
._energies_hydrogen_bond_COOH.pdf
170 Bytes
nmr_scoring_ref
._C1c_1_scores.pdf
170 Bytes
._C1c_1_scores_log.pdf
170 Bytes
._C1c_2_scores.pdf
170 Bytes
._C1c_2_scores_log.pdf
170 Bytes
._C1c_3_scores.pdf
170 Bytes
._C1c_3_scores_log.pdf
170 Bytes
._C1c_4_scores.pdf
170 Bytes
._C1c_4_scores_log.pdf
170 Bytes
._C1c_5_scores.pdf
170 Bytes
._C1c_5_scores_log.pdf
170 Bytes
._C2b_1_scores.pdf
170 Bytes
._C2b_1_scores_log.pdf
170 Bytes
._C2b_2_scores.pdf
170 Bytes
._C2b_2_scores_log.pdf
170 Bytes
._C2b_3_scores.pdf
170 Bytes
._C2b_3_scores_log.pdf
170 Bytes
._C2b_4_scores.pdf
170 Bytes
._C2b_4_scores_log.pdf
170 Bytes
._C2b_5_scores.pdf
170 Bytes
._C2b_5_scores_log.pdf
170 Bytes
._Compound_1_non_zw_1_scores.pdf
170 Bytes
._Compound_1_non_zw_1_scores_log.pdf
170 Bytes
._Compound_1_non_zw_2_scores.pdf
170 Bytes
._Compound_1_non_zw_2_scores_log.pdf
170 Bytes
._Compound_1_non_zw_3_scores.pdf
170 Bytes
._Compound_1_non_zw_3_scores_log.pdf
170 Bytes
._Compound_1_non_zw_4_scores.pdf
170 Bytes
._Compound_1_non_zw_4_scores_log.pdf
170 Bytes
._Compound_1_non_zw_5_scores.pdf
170 Bytes
._Compound_1_non_zw_5_scores_log.pdf
170 Bytes