Lane W. Votapka

According to our database, Lane W. Votapka authored at least 6 papers between 2013 and 2024.

Collaborative distances:

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

2024

NetSci: A Library for High Performance Biomolecular Simulation Network Analysis Computation.

Andrew M. Stokely, Lane W. Votapka, Marcus T. Hock, Abigail E. Teitgen, James Andrew McCammon, Andrew D. McCulloch, Rommie E. Amaro

J. Chem. Inf. Model., 2024

2023

Selectivity and Ranking of Tight-Binding JAK-STAT Inhibitors Using Markovian Milestoning with Voronoi Tessellations.

Anupam Anand Ojha, Ambuj Srivastava, Lane W. Votapka, Rommie E. Amaro

J. Chem. Inf. Model., April, 2023

2022

SEEKR2: Versatile Multiscale Milestoning Utilizing the OpenMM Molecular Dynamics Engine.

Lane W. Votapka, Andrew M. Stokely, Anupam Anand Ojha, Rommie E. Amaro

J. Chem. Inf. Model., 2022

2016

Numerical and Computational Solutions for Biochemical Kinetics, Druggability, and Simulation

Lane Votapka

PhD thesis, 2016

2015

Multiscale Estimation of Binding Kinetics Using Brownian Dynamics, Molecular Dynamics and Milestoning.

Lane W. Votapka, Rommie E. Amaro

PLoS Comput. Biol., 2015

2013

Multistructural hot spot characterization with FTProd.

Lane Votapka, Rommie E. Amaro

Bioinform., 2013