Suman Sirimulla

According to our database, Suman Sirimulla authored at least 9 papers between 2010 and 2021.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of two.

2021

A machine learning platform to estimate anti-SARS-CoV-2 activities.

Govinda B. Kc, Giovanni Bocci, Srijan Verma, Md Mahmudulla Hassan, Jayme Holmes, Jeremy J. Yang, Suman Sirimulla, Tudor I. Oprea

Nat. Mach. Intell., 2021

DrugCentral 2021 supports drug discovery and repositioning.

Sorin I. Avram, Cristian Bologa, Jayme Holmes, Giovanni Bocci, Thomas B. Wilson, Dac-Trung Nguyen, Ramona Curpan, Liliana Halip, Alina Bora, Jeremy J. Yang, Jeffrey Knockel, Suman Sirimulla, Oleg Ursu, Tudor I. Oprea

Nucleic Acids Res., 2021

BiasNet: A Model to Predict Ligand Bias Toward GPCR Signaling.

Jason E. Sanchez, Govinda B. Kc, Julian Franco, William J. Allen, Jesus David Garcia, Suman Sirimulla

J. Chem. Inf. Model., 2021

Multi-Layer Combinatorial Fusion Using Cognitive Diversity.

Landon Hurley, Bruce S. Kristal, Suman Sirimulla, Christina Schweikert, D. Frank Hsu

IEEE Access, 2021

2016

S···O and S···N Sulfur Bonding Interactions in Protein-Ligand Complexes: Empirical Considerations and Scoring Function.

Mathew R. Koebel, Aaron Cooper, Grant Schmadeke, Soyoung Jeon, Mahesh Narayan, Suman Sirimulla

J. Chem. Inf. Model., 2016

AutoDock VinaXB: implementation of XBSF, new empirical halogen bond scoring function, into AutoDock Vina.

Mathew R. Koebel, Grant Schmadeke, Richard G. Posner, Suman Sirimulla

J. Cheminformatics, 2016

BioNetFit: a fitting tool compatible with BioNetGen, NFsim and distributed computing environments.

Brandon R. Thomas, Lily A. Chylek, Joshua Colvin, Suman Sirimulla, Andrew H. A. Clayton, William S. Hlavacek, Richard G. Posner

Bioinform., 2016

2013

Halogen Interactions in Protein-Ligand Complexes: Implications of Halogen Bonding for Rational Drug Design.

Suman Sirimulla, Jake B. Bailey, Rahulsimham Vegesna, Mahesh Narayan

J. Chem. Inf. Model., 2013

2010

Prediction of Partial Molar Volumes of Amino Acids and Small Peptides: Counting Atoms versus Topological Indices.

Suman Sirimulla, Maricarmen Lerma, William C. Herndon

J. Chem. Inf. Model., 2010