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Application

Discovery Studio 0.8722707423580786 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.056140350877192984 Amorphous Cell 0.2820175438596491 Blends 0.0021929824561403508 CASTEP 0.29912280701754385 CDOCKER 0.156140350877193 CHARMm 0.24561403508771928 COMPASS 0.3482456140350877 COMPASS III 0.11754385964912281 COSMObase 0.005263157894736842 COSMOconf 0.006578947368421052 COSMOmic 0.0 COSMOperm 4.385964912280702E-4 COSMOplex 4.385964912280702E-4 COSMOquick 0.0 COSMOtherm 0.0662280701754386 Catalyst 0.06842105263157895 Classical Simulations 1.0 Conformers 4.385964912280702E-4 Crystallization 0.07675438596491228 DFTB Plus 0.0030701754385964912 DMol3 0.13815789473684212 DPD 0.0013157894736842105 Discover 0.0030701754385964912 Forcite 0.5381578947368421 GULP 0.014035087719298246 Kinetix 0.0 LUDI 0.0017543859649122807 LibDock 0.06184210526315789 LigandFit 0.0030701754385964912 MODELER 0.22280701754385965 Mesocite 0.003947368421052632 Mesoscale 0.004824561403508772 Morphology 0.017105263157894738 ONETEP 8.771929824561404E-4 Polymorph 0.002631578947368421 QMERA 0.0 Quantum Mechanics 0.4307017543859649 Reflex 0.05570175438596491 Reflex Plus 0.0 Semi-empirical 0.0043859649122807015 Sorption 0.06403508771929825 Synthia 8.771929824561404E-4 TURBOMOLE 0.0 VAMP 4.385964912280702E-4 Visualization 0.6100877192982456 X-Cell 0.0013157894736842105 ZDOCK 0.02631578947368421

Year

2024 0.0 2025 0.83235485975212 2026 1.0 2027 0.0032615786040443573

Keywords

target 1.0 potential 0.30916030534351147 analysis 0.21350190839694658 docking 0.19775763358778625 visualization 0.14408396946564886 between 0.13573473282442747 promising 0.09565839694656489 novel 0.08874045801526717 energy 0.08158396946564886 cell 0.06631679389312978 binding 0.06226145038167939 performance 0.05367366412213741 stability 0.04103053435114504 activity 0.03816793893129771 strong 0.037929389312977096 including 0.028864503816793893 strategy 0.02361641221374046 enhanced 0.022423664122137404 effective 0.017652671755725192 development 0.016221374045801526 mechanism 0.015028625954198474 experimental 0.0059637404580152676 synthesized 0.005486641221374045 design 0.002385496183206107 therapeutic 0.0
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