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Application

Discovery Studio 0.9591346153846154 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06349931475559616 Amorphous Cell 0.2832343535861124 Blends 0.001827318410232983 CASTEP 0.35434749505101265 CDOCKER 0.16110857316887467 CHARMm 0.2544540886249429 COMPASS 0.35495660118775696 COMPASS III 0.098522917618395 COSMObase 0.004263742957210294 COSMOconf 0.005329678696512867 COSMOmic 1.5227653418608191E-4 COSMOperm 0.0012182122734886553 COSMOplex 1.5227653418608191E-4 COSMOquick 0.0015227653418608193 COSMOtherm 0.0657834627683874 Catalyst 0.09136592051164916 Classical Simulations 1.0 Conformers 3.0455306837216383E-4 Crystallization 0.07111314146490026 DFTB Plus 0.0045682960255824575 DMol3 0.15791076595096695 DPD 0.0022841480127912287 Discover 0.0035023602862798843 Forcite 0.540886249428963 GULP 0.02040505558093498 Kinetix 1.5227653418608191E-4 LUDI 0.0033500837520938024 LibDock 0.06913354652048119 LigandFit 0.00395918988883813 MCSS 4.5682960255824577E-4 MODELER 0.24059692401400945 MesoDyn 7.613826709304097E-4 Mesocite 0.0028932541495355567 Mesoscale 0.00548195523069895 Modules 0.0 Morphology 0.016902695294655094 ONETEP 7.613826709304097E-4 Polymorph 0.001827318410232983 QMERA 1.5227653418608191E-4 QSAR 7.613826709304097E-4 Quantum Mechanics 0.5025125628140703 Reflex 0.051317192020709605 Reflex Plus 0.0013704888076747374 Semi-empirical 0.006091061367443277 Sorption 0.056494594183036394 Synthia 0.0013704888076747374 TURBOMOLE 3.0455306837216383E-4 VAMP 0.0010659357393025734 Visualization 0.7351911070504036 X-Cell 0.0015227653418608193 ZDOCK 0.027866605756052994

Year

2023 0.06249271306983794 2024 0.49527806925498424 2025 1.0 2026 0.49527806925498424 2027 0.0

Keywords

target 1.0 potential 0.2938395314374427 docking 0.2114176840025404 analysis 0.20633688518806012 visualization 0.17387622609554723 between 0.1529179309858161 novel 0.0981582104297509 energy 0.08376261378872345 promising 0.075506315715193 binding 0.0697904170489027 cell 0.06350998518100345 activity 0.048832121939171545 stability 0.0405758238656411 performance 0.039305624162021026 synthesized 0.021452261661138946 experimental 0.02081716180932891 including 0.020746595159127797 interaction 0.019758662056312187 effective 0.018629595653094348 mechanism 0.016724296097664244 development 0.016159762896055325 enhanced 0.00726836497071484 protein 0.006209865217698116 synthesis 7.056665020111495E-4 design 0.0
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