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Application

Discovery Studio 1.0 Materials Studio 0.8041445539550164 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05621925509486999 Amorphous Cell 0.2607167955024596 Blends 0.002459592410400562 CASTEP 0.28777231201686576 CDOCKER 0.19184820801124386 CHARMm 0.3106113843991567 COMPASS 0.32150386507378775 COMPASS III 0.10014054813773718 COSMObase 0.003865073787772312 COSMOconf 0.0066760365425158116 COSMOmic 0.0 COSMOperm 7.027406886858749E-4 COSMOplex 3.5137034434293746E-4 COSMOquick 3.5137034434293746E-4 COSMOtherm 0.059030217849613494 Catalyst 0.0881939564300773 Classical Simulations 1.0 Conformers 3.5137034434293746E-4 Crystallization 0.0713281799016163 DFTB Plus 0.0017568517217146872 DMol3 0.1324666198172874 DPD 0.0014054813773717498 Discover 0.005270555165144062 Forcite 0.49929725931131413 GULP 0.012649332396345749 Kinetix 0.0 LUDI 0.004567814476458187 LibDock 0.08081517919887561 LigandFit 0.004567814476458187 MCSS 3.5137034434293746E-4 MODELER 0.2905832747716093 MesoDyn 7.027406886858749E-4 Mesocite 0.003162333099086437 Mesoscale 0.005270555165144062 Morphology 0.01651440618411806 ONETEP 7.027406886858749E-4 Polymorph 0.0017568517217146872 QMERA 0.0 QSAR 3.5137034434293746E-4 Quantum Mechanics 0.4128601546029515 Reflex 0.05200281096275474 Reflex Plus 0.0 Semi-empirical 0.003162333099086437 Sorption 0.05165144061841181 Synthia 7.027406886858749E-4 TURBOMOLE 0.0 VAMP 7.027406886858749E-4 Visualization 0.7673928320449754 X-Cell 0.0014054813773717498 ZDOCK 0.03478566408995081

Year

2024 0.2710204081632653 2025 1.0 2026 0.8068027210884354 2027 0.0

Keywords

target 1.0 potential 0.3310437259172391 docking 0.2636957614340761 analysis 0.22918411794270396 visualization 0.1859607974535098 between 0.13586865471603285 novel 0.10604791422348803 binding 0.09800636622549841 promising 0.09716870497570783 activity 0.0623219969844195 cell 0.054447981236388006 energy 0.04841682023789579 stability 0.041547997989613 including 0.030993466242251633 development 0.02395711174401072 strong 0.023789579494052606 therapeutic 0.017590886245602278 performance 0.016753224995811694 mechanism 0.015077902496230524 effective 0.014575305746356173 synthesized 0.013402579996649355 protein 0.013235047746691238 interaction 0.0077064834980733795 enhanced 0.004690902998827275 synthesis 0.0
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