Ashutosh Kumar

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

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2021

Lean-Docking: Exploiting Ligands' Predicted Docking Scores to Accelerate Molecular Docking.

Francois Berenger, Ashutosh Kumar, Kam Y. J. Zhang, Yoshihiro Yamanishi

J. Chem. Inf. Model., 2021

An integrated computational pipeline for designing high-affinity nanobodies with expanded genetic codes.

Aditya K. Padhi, Ashutosh Kumar, Ken-ichi Haruna, Haruna Sato, Hiroko Tamura, Satoru Nagatoishi, Kouhei Tsumoto, Atushi Yamaguchi, Fumie Iraha, Mihoko Takahashi, Kensaku Sakamoto, Kam Y. J. Zhang

Briefings Bioinform., 2021

2019

Improving ligand 3D shape similarity-based pose prediction with a continuum solvent model.

Ashutosh Kumar, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2019

Shape similarity guided pose prediction: lessons from D3R Grand Challenge 3.

Ashutosh Kumar, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2019

2018

A cross docking pipeline for improving pose prediction and virtual screening performance.

Ashutosh Kumar, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2018

2017

Discovery of Fungal Denitrification Inhibitors by Targeting Copper Nitrite Reductase from <i>Fusarium oxysporum</i>.

Masaki Matsuoka, Ashutosh Kumar, Muhammad Muddassar, Akihisa Matsuyama, Minoru Yoshida, Kam Y. J. Zhang

J. Chem. Inf. Model., 2017

2016

A Novel Scaffold for Developing Specific or Broad-Spectrum Chitinase Inhibitors.

Xi Jiang, Ashutosh Kumar, Tian Liu, Kam Y. J. Zhang, Qing Yang

J. Chem. Inf. Model., 2016

Application of Shape Similarity in Pose Selection and Virtual Screening in CSARdock2014 Exercise.

Ashutosh Kumar, Kam Y. J. Zhang

J. Chem. Inf. Model., 2016

Prospective evaluation of shape similarity based pose prediction method in D3R Grand Challenge 2015.

Ashutosh Kumar, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2016

A pose prediction approach based on ligand 3D shape similarity.

Ashutosh Kumar, Kam Y. J. Zhang

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.

Ashutosh Kumar, Akihiro Ito, Misao Takemoto, Minoru Yoshida, Kam Y. J. Zhang

J. Chem. Inf. Model., 2014

Identification of Sumoylation Inhibitors Targeting a Predicted Pocket in Ubc9.

Ashutosh Kumar, Akihiro Ito, Mikako Hirohama, Minoru Yoshida, Kam Y. J. Zhang

J. Chem. Inf. Model., 2014

Identification of SUMO activating enzyme 1 inhibitors utilizing virtual screening approach.

Ashutosh Kumar, Akihiro Ito, Mikako Hirohama, Minoru Yoshida, Kam Y. J. Zhang

J. Cheminformatics, 2014

Combining in silico and in cerebro approaches for virtual screening and pose prediction in SAMPL4.

Arnout R. D. Voet, Ashutosh Kumar, Francois Berenger, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2014

2013

Investigation on the Effect of Key Water Molecules on Docking Performance in CSARdock Exercise.

Ashutosh Kumar, Kam Y. J. Zhang

J. Chem. Inf. Model., 2013

Identification of Sumoylation Activating Enzyme 1 Inhibitors by Structure-Based Virtual Screening.

Ashutosh Kumar, Akihiro Ito, Mikako Hirohama, Minoru Yoshida, Kam Y. J. Zhang

J. Chem. Inf. Model., 2013

2012

Computational fragment-based screening using RosettaLigand: the SAMPL3 challenge.

Ashutosh Kumar, Kam Y. J. Zhang

J. Comput. Aided Mol. Des., 2012