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Application

Discovery Studio 1.0 Materials Studio 0.9348127600554785 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.038984587488667274 Amorphous Cell 0.2611060743427017 Antibody 0.0 Blends 0.001813236627379873 CASTEP 0.35811423390752495 CDOCKER 0.21940163191296463 CHARMm 0.3209428830462375 COMPASS 0.34632819582955576 COMPASS III 0.06255666364460562 COSMObase 0.005439709882139619 COSMOconf 0.0027198549410698096 COSMOplex 0.0 COSMOquick 0.007252946509519492 COSMOtherm 0.07978241160471441 Catalyst 0.22030825022665457 Classical Simulations 1.0 Conformers 9.066183136899365E-4 Crystallization 0.08884859474161379 DFTB Plus 0.004533091568449683 DMol3 0.2184950135992747 DPD 0.001813236627379873 Discover 0.003626473254759746 Forcite 0.49229374433363554 GULP 0.028105167724388033 LUDI 0.019038984587488667 LibDock 0.09247506799637353 LigandFit 0.012692656391659111 MCSS 0.004533091568449683 MODELER 0.18223028105167724 MesoDyn 0.0 Mesocite 0.003626473254759746 Mesoscale 0.005439709882139619 Morphology 0.025385312783318223 Polymorph 9.066183136899365E-4 QMERA 0.0 QSAR 0.005439709882139619 Quantum Mechanics 0.5684496826835902 Reflex 0.061650045330915684 Semi-empirical 0.008159564823209429 Sorption 0.04895738893925657 Synthia 0.0 TURBOMOLE 9.066183136899365E-4 VAMP 0.001813236627379873 Visualization 0.6890299184043518 ZDOCK 0.030825022665457842

Year

2019 0.0 2020 0.19089574155653452 2021 0.22466960352422907 2022 0.26284875183553597 2023 0.6813509544787077 2024 0.9779735682819384 2025 1.0 2026 0.42143906020558003

Keywords

design 1.0 target 0.9483870967741935 potential 0.21859582542694497 novel 0.21518026565464896 docking 0.19620493358633775 synthesis 0.1840607210626186 between 0.13055028462998103 visualization 0.1256166982922201 synthesized 0.11461100569259962 analysis 0.10132827324478179 promising 0.0872865275142315 activity 0.076280834914611 development 0.07552182163187855 designed 0.07172675521821632 compound 0.0683111954459203 cell 0.06375711574952561 energy 0.06261859582542695 binding 0.05047438330170778 performance 0.047817836812144215 effective 0.028842504743833017 stability 0.028842504743833017 potent 0.02732447817836812 strategy 0.004933586337760911 active 0.0022770398481973433 interaction 0.0
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