OOIR: Observatory of International Research

Papers

(The H4-Index of Wiley Interdisciplinary Reviews-Computational Molecular Science is 30. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-08-01 to 2025-08-01.)

Article	Citations
	2943
Moving in the mesoscale: Understanding the mechanics of cytoskeletal molecular motors by combining mesoscale simulations with imaging	227
Issue Information	193
Quantitative analysis of high‐throughput biological data	170
Time‐dependent coupled‐cluster theory	152
	120
Range‐separated multiconfigurational density functional theory methods	101
Two decades of Martini: Better beads, broader scope	96
Theoretical Studies of Molecular Reactions at the Air–Water Interface: Recent Progress and Perspective	95
Recent advances in deep learning for retrosynthesis	82
Computational studies of protein–drug binding affinity changes upon mutations in the drug target	66
Small molecule superposition: A comprehensive overview on pose scoring of the latest methods	63
Cover Image, Volume 12, Issue 5	55
Issue Information	54
Using machine‐learning‐driven approaches to boost hot‐spot's knowledge	50
Cover Image, Volume 12, Issue 1	48
UniversalQM/MMapproaches for general nanoscale applications	47
Computation of Time‐Resolved Nonlinear Electronic Spectra From Classical Trajectories	42
	41
Computational methods for unlocking the secrets of potassium channels: Structure, mechanism, and drug design	40
The repetitive local sampling and the local distribution theory	40
Superconducting ternary hydrides under high pressure	39
Building Nucleosome Positioning Maps: Discovering Hidden Gems	36
Deciphering the mechanical properties of B‐DNA duplex	36
Advanced quantum and semiclassical methods for simulating photoinduced molecular dynamics and spectroscopy	34

	32
Graph neural networks for conditional de novo drug design	31
Enhanced sampling strategies for molecular simulation of DNA	31
A promising intersection of excited‐state‐specific methods from quantum chemistry and quantum Monte Carlo	31
	30