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Application

Discovery Studio 0.93364700850131 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06903121793932288 Amorphous Cell 0.2808881723582002 Blends 0.00300454345595779 CASTEP 0.42613219991206214 CDOCKER 0.16576286091162246 CHARMm 0.24476036933900044 COMPASS 0.38355562069470905 COMPASS III 0.0729884215154624 COSMObase 0.002784698812838927 COSMOconf 0.00329766964678294 COSMOmic 2.1984464311886268E-4 COSMOperm 0.0012457863110068885 COSMOplex 3.664077385314378E-4 COSMOquick 0.0015389125018320387 COSMOtherm 0.06507401436318334 Cantera 7.328154770628756E-5 Catalyst 0.1183496995456544 Classical Simulations 1.0 Conformers 0.001319067858713176 Crystallization 0.07797156675948996 DFTB Plus 0.006082368459621867 DMol3 0.19573501392349407 DPD 0.0030778250036640775 Discover 0.005202989887146416 Forcite 0.5418437637402902 GULP 0.027407298842151546 Kinetix 2.1984464311886268E-4 LUDI 0.005129708339440129 LibDock 0.06756558698519713 LigandFit 0.007108310127509893 MCSS 0.0010992232155943133 MODELER 0.17756119009233476 MesoDyn 0.0017587571449509014 Mesocite 0.004250329766964678 Mesoscale 0.007914407152279056 Modules 0.0 Morphology 0.018173823831159314 ONETEP 0.001319067858713176 Polymorph 0.0019053202403634766 QMERA 2.1984464311886268E-4 QSAR 0.0015389125018320387 Quantum Mechanics 0.6088230983438371 Reflex 0.057599296497142016 Reflex Plus 6.59533929356588E-4 Semi-empirical 0.008280814890810494 Sorption 0.055107723875128245 Synthia 0.0013923494064194636 TURBOMOLE 5.862523816503004E-4 VAMP 0.001832038692657189 Visualization 0.8381210611168108 X-Cell 0.0011725047633006009 ZDOCK 0.028799648248571008

Year

2020 0.0 2021 0.16772339166455322 2022 0.2909797954180404 2023 0.5009721869980557 2024 1.0 2025 0.9676219460647562 2026 0.3601318792797362 2027 7.60841998478316E-4

Keywords

target 1.0 potential 0.25406942231386886 docking 0.20073733870715782 visualization 0.1988002624425907 analysis 0.17343081200987284 between 0.1539038335364139 novel 0.0949479801293467 energy 0.08844940169337957 binding 0.061642765645015155 cell 0.057862342612553505 activity 0.04555253538288499 promising 0.041459680694848004 interaction 0.037772987159058954 experimental 0.031149436060861686 stability 0.026556690723904146 synthesized 0.026244259068328803 performance 0.01833973818227263 mechanism 0.01771487487112194 effective 0.016371418752147968 development 0.014465585653138376 protein 0.011997375574093166 synthesis 0.009747867653950698 including 0.006623551098197269 chemical 0.004311556846939732 design 0.0
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