Vijay Pande
Stanford University
H-index: 117
North America-United States
Top articles of Vijay Pande
Title | Journal | Author(s) | Publication Date |
---|---|---|---|
Systems and Methods for Spatial Graph Convolutions with Applications to Drug Discovery and Molecular Simulation | 2023/9/7 | ||
Folding@ home: achievements from over twenty years of citizen science herald the exascale era | Vincent A Voelz Vijay S Pande Gregory R Bowman | 2023/3/15 | |
Openmm 8: Molecular dynamics simulation with machine learning potentials | The Journal of Physical Chemistry B | Peter Eastman Raimondas Galvelis Raúl P Peláez Charlles RA Abreu Stephen E Farr | 2023/12/28 |
Ligands of the mu, kappa, and delta opioid receptors | 2022/1/4 | ||
Systems and Methods for Active Transfer Learning with Deep Featurization | 2021/11/18 | ||
Computational IR spectroscopy of insulin dimer structure and conformational heterogeneity | The Journal of Physical Chemistry B | Chi-Jui Feng Anton Sinitskiy Vijay Pande Andrei Tokmakoff | 2021/4/30 |
A Modular DNA Scaffold to Study Protein-Protein Interactions at Single-Molecule Resolution | Biophysical Journal | Dorota N Kostrz Hannah K Wayment-Steele Jinglong Wang Maryne Follenfant Vijay S Pande | 2020/2/7 |
A targeted computational screen of the SWEETLEAD database reveals FDA-approved compounds with anti-dengue viral activity | Mbio | Jasmine Moshiri David A Constant Bowen Liu Roberto Mateo Steven Kearnes | 2020/12/22 |
Improvement in ADMET prediction with multitask deep featurization | Journal of Medicinal Chemistry | Evan Feinberg Elizabeth M Joshi Vijay S Pande Alan Cheng | 2020/4/14 |
Dynamical model of the CLC-2 ion channel reveals conformational changes associated with selectivity-filter gating | PLoS Computational Biology | Keri A McKiernan Anna K Koster Merritt Maduke Vijay S Pande | 2020/3/30 |
Deep Learning für die Biowissenschaften: Einsatz von Deep Learning in Genomik, Biophysik, Mikroskopie und medizinischer Analyse | Bharath Ramsundar Peter Eastman Patrick Walters Vijay Pande | 2020/2/25 | |
Rep-X: An evolution-guided Strategy for the Rational Design of cysteine-less protein Variants | Scientific Reports | Kevin Dalton Tom Lopez Vijay Pande Judith Frydman | 2020/2/10 |