3d-qsar models Search Results


3d-qsar pharmacophore generation  (Hypogen Inc)
90
Hypogen Inc 3d-qsar pharmacophore generation
3d Qsar Pharmacophore Generation, supplied by Hypogen Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+pharmacophore+models/10__1039_slash_c6ra24959k-35-21-24
Average 90 stars, based on 1 article reviews
3d-qsar pharmacophore generation - by Bioz Stars, 2026-10
90/100 stars
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3d-qsar models  (Schrodinger LLC)
90
Schrodinger LLC 3d-qsar models
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Models, supplied by Schrodinger LLC, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+models/pmc06940830-258-3-10
Average 90 stars, based on 1 article reviews
3d-qsar models - by Bioz Stars, 2026-10
90/100 stars
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2d/3d-qsar or classification models  (Muegge GmbH)
90
Muegge GmbH 2d/3d-qsar or classification models
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
2d/3d Qsar Or Classification Models, supplied by Muegge GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/2d+3d+qsar+or+classification+models/pmc06886474-123-28-41
Average 90 stars, based on 1 article reviews
2d/3d-qsar or classification models - by Bioz Stars, 2026-10
90/100 stars
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3d-qsar model  (PostEra Inc)
90
PostEra Inc 3d-qsar model
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Model, supplied by PostEra Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+model/pmc07685905-161-21-28
Average 90 stars, based on 1 article reviews
3d-qsar model - by Bioz Stars, 2026-10
90/100 stars
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3d-qsar model 1  (AUTODOCK GmbH)
90
AUTODOCK GmbH 3d-qsar model 1
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Model 1, supplied by AUTODOCK GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+model+1/pm32141385-271-30-36
Average 90 stars, based on 1 article reviews
3d-qsar model 1 - by Bioz Stars, 2026-10
90/100 stars
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3d-qsar models  (Informa UK Limited)
90
Informa UK Limited 3d-qsar models
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Models, supplied by Informa UK Limited, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+model/pm37539779-28-51-40
Average 90 stars, based on 1 article reviews
3d-qsar models - by Bioz Stars, 2026-10
90/100 stars
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generalized 3d-qsar model of camptothecin analogs  (Verlag GmbH)
90
Verlag GmbH generalized 3d-qsar model of camptothecin analogs
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
Generalized 3d Qsar Model Of Camptothecin Analogs, supplied by Verlag GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/generalized+3d+qsar+model+of+camptothecin+analogs/pm27468148-174-19-7
Average 90 stars, based on 1 article reviews
generalized 3d-qsar model of camptothecin analogs - by Bioz Stars, 2026-10
90/100 stars
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3d qsar models  (Marburg GmbH)
90
Marburg GmbH 3d qsar models
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Models, supplied by Marburg GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+models/pm18211050-5-2-21
Average 90 stars, based on 1 article reviews
3d qsar models - by Bioz Stars, 2026-10
90/100 stars
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3d-qsar model phase, version 3.2  (Schrodinger LLC)
90
Schrodinger LLC 3d-qsar model phase, version 3.2
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
3d Qsar Model Phase, Version 3.2, supplied by Schrodinger LLC, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/3d+qsar+model+phase++version+3+2/10__1080_slash_1062936x__2015__1136679-25-12-15
Average 90 stars, based on 1 article reviews
3d-qsar model phase, version 3.2 - by Bioz Stars, 2026-10
90/100 stars
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fbg-based 3d qsar pharmacophore model  (Hypogen Inc)
90
Hypogen Inc fbg-based 3d qsar pharmacophore model
<t>3D-QSAR</t> model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).
Fbg Based 3d Qsar Pharmacophore Model, supplied by Hypogen Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/3d-qsar+models/fbg+based+3d+qsar+pharmacophore+model/pm32387857-28-30-49
Average 90 stars, based on 1 article reviews
fbg-based 3d qsar pharmacophore model - by Bioz Stars, 2026-10
90/100 stars
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Image Search Results


3D-QSAR model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).

Journal: International Journal of Molecular Sciences

Article Title: Structural Requirements of N -alpha-Mercaptoacetyl Dipeptide (NAMdP) Inhibitors of Pseudomonas Aeruginosa Virulence Factor LasB: 3D-QSAR, Molecular Docking, and Interaction Fingerprint Studies

doi: 10.3390/ijms20246133

Figure Lengend Snippet: 3D-QSAR model contour maps obtained with the five force fields and represented around the most active inhibitor in the dataset (compound 103 , HSCH 2 CO–Trp–Tyr–NH 2 ). ( A ) Steric—the favorable and unfavorable components are in green (G1 and G2) and in yellow (Y1), respectively. ( B ) Electrostatic—the favorable and unfavorable components are in blue (B1 and B2) and in red (R1 and R2), respectively. ( C ) Hydrogen bond (HB)–donor—the favorable and unfavorable components are in white (W1 and W2) and in cyan (C1), respectively, and ( D ) HB–acceptor—the favorable components are in maroon (M1, M2, and M3). ( E ) Hydrophobic—the favorable components are in pink (P1, P2, and P3).

Article Snippet: Moreover, the field-based 3D-QSAR models were trained in Phase (Phase, Schrodinger LLC, New York, NY, USA, 2016) by the random splitting implemented in this tool, getting a relation training/test sets of approximately 80/20 (95 and 23 compounds in training and test sets, respectively).

Techniques: