Diogo Santos‐Martins

Computer ScienceBiochemistry, Genetics and Molecular BiologyMaterials ScienceImmunology and MicrobiologyChemistry

Pilot corpus only

This score is computed over theSindex pilot corpus and does not cover the full scientific literature. Scores are relative to papers we have ingested — papers, authors, and institutions outside the pilot are not represented. Methodology.

Top 100%percentile

0Author DataRank

Indexed papers

0in pilot corpus

datarank_citation_only_1hop_v6· scope data_onlyMethodology

Papers

Driven by 18 papers. Top paper: “Benchmarking the performance of irregular computations in AutoDock-GPU molecular docking”.

Benchmarking the performance of irregular computations in AutoDock-GPU molecular docking

Parallel Computing(2021)10.1016/j.parco.2021.102861

N/A

0.564DataRank · unranked

42 citations

Andreas F. Tillack, Diogo Santos‐Martins, Andreas Koch, Scott LeGrand, Stefano Forli +1 more

Reactive Docking: A Computational Method for High-Throughput Virtual Screenings of Reactive Species

Journal of Chemical Information and Modeling(2023)10.1021/acs.jcim.3c00832

N/A

0.345DataRank · unranked

9 citations

Matthew Holcomb, Diogo Santos‐Martins, Andreas F. Tillack, Althea Hansel-Harris, Stefano Forli +1 more

A Strain-Specific Inhibitor of Receptor-Bound HIV-1 Targets a Pocket near the Fusion Peptide

Cell Reports(2020)10.1016/j.celrep.2020.108428

N/A

0.330DataRank · unranked

8 citations

Jonathan L. Torres, Diogo Santos‐Martins, Stefano Forli, Andrew B. Ward, Gabriel Ozorowski

Discovery of Potent Coumarin-Based Kinetic Stabilizers of Amyloidogenic Immunoglobulin Light Chains Using Structure-Based Design

Journal of Medicinal Chemistry(2021)10.1021/acs.jmedchem.1c00339

N/A

0DataRank · unranked

32 citations

Diogo Santos‐Martins, Reji Nair, Alan Chu, Ian A. Wilson, Kristen A. Johnson +5 more

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

ChemRxiv(2021)10.26434/chemrxiv.14774223.v1

N/A

0DataRank · unranked

166 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Jérôme Eberhardt

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

ChemRxiv(2021)10.26434/chemrxiv.14774223

N/A

0DataRank · unranked

58 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Jérôme Eberhardt

Performance evaluation of flexible macrocycle docking in AutoDock

QRB Discovery(2022)10.1017/qrd.2022.18

N/A

0DataRank · unranked

15 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Matthew Holcomb

Performance evaluation of flexible macrocycle docking in AutoDock

ChemRxiv(2022)10.26434/chemrxiv-2022-txdt0

N/A

0DataRank · unranked

0 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Matthew Holcomb

Recommendation: Performance evaluation of flexible macrocycle docking in AutoDock — R0/PR3

(2022)10.1017/qrd.2022.18.pr3

N/A

0DataRank · unranked

0 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Matthew Holcomb

Ringtail: a Python tool for efficient management and storage of virtual screening results

ChemRxiv(2022)10.26434/chemrxiv-2022-x9ztv

N/A

0DataRank · unranked

0 citations

Andreas F. Tillack, Diogo Santos‐Martins, Matthew Holcomb, Stefano Forli, Althea Hansel-Harris

Ringtail: A Python Tool for Efficient Management and Storage of Virtual Screening Results

Journal of Chemical Information and Modeling(2023)10.1021/acs.jcim.3c00166

N/A

0DataRank · unranked

1 citations

Diogo Santos‐Martins, Niccolò Bruciaferri, Andreas F. Tillack, Matthew Holcomb, Stefano Forli +1 more

IP6, PF74 affect HIV-1 capsid stability through modulation of hexamer-hexamer tilt angle preference

Biophysical Journal(2024)10.1016/j.bpj.2024.12.016

N/A

0DataRank · unranked

1 citations

Matthew Holcomb, Diogo Santos‐Martins, Bruce E. Torbett, Stefano Forli, Christina Garza

Docking guidance with experimental ligandstructural density improves docking poseprediction and virtual screening performance

ChemRxiv(2024)10.26434/chemrxiv-2024-pr56v

N/A

0DataRank · unranked

1 citations

Andreas F. Tillack, Diogo Santos‐Martins, Matthew Holcomb, Stefano Forli, Althea Hansel-Harris

IP6 and PF74 affect HIV-1 Capsid Stability through Modulation of Hexamer-Hexamer Tilt Angle Preference

bioRxiv (Cold Spring Harbor Laboratory)(2024)10.1101/2024.03.11.584513

N/A

0DataRank · unranked

0 citations

Matthew Holcomb, Diogo Santos‐Martins, Bruce E. Torbett, Stefano Forli, Christina Garza

Structural basis for strand-transfer inhibitor binding to HIV intasomes

Science(2020)10.1126/science.aay8015

N/A

0DataRank · unranked

111 citations

Min Li, I.K. Jozwik, Xue Zhi Zhao, Diogo Santos‐Martins, Renbin Yang +8 more

Meeko: molecule parameterization and software interoperability for docking and beyond

ChemRxiv(2025)10.26434/chemrxiv-2025-6b37n

N/A

0DataRank · unranked

2 citations

Yiran He, Jérôme Eberhardt, Parnika Sharma, Niccolò Bruciaferri, Matthew Holcomb +10 more

Structural basis for the stabilization of amyloidogenic immunoglobulin light chains by hydantoins

Bioorganic & Medicinal Chemistry Letters(2020)10.1016/j.bmcl.2020.127356

N/A

0DataRank · unranked

23 citations

Diogo Santos‐Martins, Enrico Rennella, Brittany B. Sanchez, Jason S. Chen, Lewis E. Kay +5 more

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

Journal of Chemical Information and Modeling(2021)10.1021/acs.jcim.1c00203

N/A

0DataRank · unranked

6852 citations

Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli, Jérôme Eberhardt