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Application

Discovery Studio 1.0 Materials Studio 0.9613030957523399 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.055427782888684454 Amorphous Cell 0.2769089236430543 Blends 0.001609935602575897 CASTEP 0.3316467341306348 CDOCKER 0.17479300827966882 CHARMm 0.2702391904323827 COMPASS 0.34590616375344985 COMPASS III 0.10602575896964121 COSMObase 0.00390984360625575 COSMOconf 0.005059797608095676 COSMOmic 2.2999080036798528E-4 COSMOperm 4.5998160073597056E-4 COSMOplex 2.2999080036798528E-4 COSMOquick 9.199632014719411E-4 COSMOtherm 0.06393744250229991 Catalyst 0.09452621895124196 Classical Simulations 1.0 Conformers 4.5998160073597056E-4 Crystallization 0.07290708371665133 DFTB Plus 0.004829806807727691 DMol3 0.15179392824287027 DPD 0.0022999080036798527 Discover 0.003219871205151794 Forcite 0.5264489420423183 GULP 0.017479300827966882 Kinetix 2.2999080036798528E-4 LUDI 0.002529898804047838 LibDock 0.07152713891444343 LigandFit 0.0043698252069917206 MODELER 0.250229990800368 MesoDyn 0.0 Mesocite 0.0027598896044158236 Mesoscale 0.004829806807727691 Modules 0.0 Morphology 0.017479300827966882 ONETEP 0.0011499540018399263 Polymorph 0.0022999080036798527 QMERA 0.0 QSAR 2.2999080036798528E-4 Quantum Mechanics 0.4753909843606256 Reflex 0.05220791168353266 Reflex Plus 0.0013799448022079118 Semi-empirical 0.006209751609935602 Sorption 0.06048758049678013 Synthia 0.0011499540018399263 TURBOMOLE 2.2999080036798528E-4 VAMP 9.199632014719411E-4 Visualization 0.7585096596136155 X-Cell 9.199632014719411E-4 ZDOCK 0.02828886844526219

Year

2023 0.053765293813544716 2024 0.3966913665345511 2025 1.0 2026 0.5693606755126659 2027 0.0

Keywords

target 1.0 potential 0.30301082181506483 docking 0.2247937426336655 analysis 0.21054323368691738 visualization 0.18011357548483875 between 0.14207650273224043 novel 0.09450337512054002 promising 0.07982427943855137 energy 0.07607414550519662 binding 0.07221686488803171 cell 0.05893067609557484 activity 0.05400192864030858 stability 0.03717989928211722 performance 0.03439408550305368 synthesized 0.02239365691631844 including 0.021000750026786672 development 0.016822029358191364 mechanism 0.014786242365798778 effective 0.013821922211507553 experimental 0.013179042108646738 interaction 0.01253616200578592 enhanced 0.0048216007714561235 protein 0.0047144540876459876 strong 0.0021429336762027215 synthesis 0.0
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