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Application

Discovery Studio 1.0 Materials Studio 0.973575036075036 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06413752222880853 Amorphous Cell 0.27634854771784234 Blends 0.0024896265560165973 CASTEP 0.3746295198577356 CDOCKER 0.16929460580912864 CHARMm 0.2676941315945465 COMPASS 0.34878482513337283 COMPASS III 0.08962655601659751 COSMObase 0.003912270302311796 COSMOconf 0.004742145820983995 COSMOmic 1.1855364552459988E-4 COSMOperm 0.0014226437462951985 COSMOplex 1.1855364552459988E-4 COSMOquick 0.0014226437462951985 COSMOtherm 0.06307053941908713 Cantera 0.0 Catalyst 0.11760521636040308 Classical Simulations 1.0 Conformers 7.113218731475993E-4 Crystallization 0.07077652637818613 DFTB Plus 0.0052163604030823945 DMol3 0.16704208654416122 DPD 0.0026081802015411972 Discover 0.0035566093657379964 Forcite 0.5312388855957321 GULP 0.021813870776526377 Kinetix 2.3710729104919976E-4 LUDI 0.004149377593360996 LibDock 0.07113218731475993 LigandFit 0.004979253112033195 MCSS 5.927682276229994E-4 MODELER 0.21256668642560758 MesoDyn 8.298755186721991E-4 Mesocite 0.003082394783639597 Mesoscale 0.006046235921754594 Modules 0.0 Morphology 0.016597510373443983 ONETEP 0.0011855364552459987 Polymorph 0.002015411973918198 QMERA 1.1855364552459988E-4 QSAR 9.48429164196799E-4 Quantum Mechanics 0.5311203319502075 Reflex 0.051452282157676346 Reflex Plus 0.0010669828097213988 Semi-empirical 0.0067575577949021935 Sorption 0.056075874333135746 Synthia 0.0011855364552459987 TURBOMOLE 4.742145820983995E-4 VAMP 0.0011855364552459987 Visualization 0.819561351511559 X-Cell 0.0014226437462951985 ZDOCK 0.028097213989330173

Year

2022 9.166743056192135E-5 2023 0.2760106334219452 2024 0.487212393436612 2025 1.0 2026 0.38958657988816575 2027 0.0

Keywords

target 1.0 potential 0.2959103110690036 docking 0.23043318069372073 analysis 0.20380020001052687 visualization 0.20327385651876415 between 0.15358703089636297 novel 0.10516342965419233 energy 0.08526764566556135 binding 0.07795147113005947 promising 0.06863519132585925 cell 0.06331912205905574 activity 0.05700300015790305 stability 0.039423127533028055 interaction 0.03468603610716353 performance 0.032054318648349914 synthesized 0.0307384599189431 experimental 0.025685562398020948 development 0.022527501447444604 including 0.021474814463919155 effective 0.021159008368861518 protein 0.020685299226275065 mechanism 0.020632664877098795 synthesis 0.012632243802305385 design 0.003631770093162798 enhanced 0.0
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