Ashutosh Kumar

Orcid: 0000-0003-3754-8996

Affiliations:
  • RIKEN, Japan


According to our database1, Ashutosh Kumar authored at least 17 papers between 2012 and 2021.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

Legend:

Book 
In proceedings 
Article 
PhD thesis 
Dataset
Other 

Links

Online presence:

On csauthors.net:

Bibliography

2021
Lean-Docking: Exploiting Ligands' Predicted Docking Scores to Accelerate Molecular Docking.
J. Chem. Inf. Model., 2021

An integrated computational pipeline for designing high-affinity nanobodies with expanded genetic codes.
Briefings Bioinform., 2021

2019
Improving ligand 3D shape similarity-based pose prediction with a continuum solvent model.
J. Comput. Aided Mol. Des., 2019

Shape similarity guided pose prediction: lessons from D3R Grand Challenge 3.
J. Comput. Aided Mol. Des., 2019

2018
A cross docking pipeline for improving pose prediction and virtual screening performance.
J. Comput. Aided Mol. Des., 2018

2017
Discovery of Fungal Denitrification Inhibitors by Targeting Copper Nitrite Reductase from <i>Fusarium oxysporum</i>.
J. Chem. Inf. Model., 2017

2016
A Novel Scaffold for Developing Specific or Broad-Spectrum Chitinase Inhibitors.
J. Chem. Inf. Model., 2016

Application of Shape Similarity in Pose Selection and Virtual Screening in CSARdock2014 Exercise.
J. Chem. Inf. Model., 2016

Prospective evaluation of shape similarity based pose prediction method in D3R Grand Challenge 2015.
J. Comput. Aided Mol. Des., 2016

A pose prediction approach based on ligand 3D shape similarity.
J. Comput. Aided Mol. Des., 2016

2014
Identification of 1, 2, 5-Oxadiazoles as a New Class of SENP2 Inhibitors Using Structure Based Virtual Screening.
J. Chem. Inf. Model., 2014

Identification of Sumoylation Inhibitors Targeting a Predicted Pocket in Ubc9.
J. Chem. Inf. Model., 2014

Identification of SUMO activating enzyme 1 inhibitors utilizing virtual screening approach.
J. Cheminformatics, 2014

Combining in silico and in cerebro approaches for virtual screening and pose prediction in SAMPL4.
J. Comput. Aided Mol. Des., 2014

2013
Investigation on the Effect of Key Water Molecules on Docking Performance in CSARdock Exercise.
J. Chem. Inf. Model., 2013

Identification of Sumoylation Activating Enzyme 1 Inhibitors by Structure-Based Virtual Screening.
J. Chem. Inf. Model., 2013

2012
Computational fragment-based screening using RosettaLigand: the SAMPL3 challenge.
J. Comput. Aided Mol. Des., 2012


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