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Application

Discovery Studio 1.0 Materials Studio 0.7140888735790561 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.055356227575602254 Amorphous Cell 0.2450025627883137 Blends 0.0025627883136852894 CASTEP 0.27011788826242955 CDOCKER 0.2142491030240902 CHARMm 0.3418759610456176 COMPASS 0.3044592516658124 COMPASS III 0.10507432086109687 COSMObase 0.004100461301896463 COSMOconf 0.007688364941055869 COSMOmic 0.0 COSMOperm 0.0010251153254741158 COSMOplex 5.125576627370579E-4 COSMOquick 0.0 COSMOtherm 0.06304459251665813 Catalyst 0.09636084059456688 Classical Simulations 1.0 Conformers 5.125576627370579E-4 Crystallization 0.07278318810866223 DFTB Plus 0.0020502306509482316 DMol3 0.12352639671963096 DPD 0.0020502306509482316 Discover 0.0035879036391594054 Forcite 0.47104049205535625 GULP 0.010763710917478216 Kinetix 0.0 LUDI 0.0046130189646335215 LibDock 0.08867247565351102 LigandFit 0.0046130189646335215 MODELER 0.3121476166068683 Mesocite 0.0030753459764223477 Mesoscale 0.0046130189646335215 Morphology 0.016914402870322913 ONETEP 0.0010251153254741158 Polymorph 0.0025627883136852894 QSAR 0.0 Quantum Mechanics 0.3900563813429011 Reflex 0.051255766273705795 Reflex Plus 0.0 Semi-empirical 0.0025627883136852894 Sorption 0.05433111225012814 Synthia 0.0010251153254741158 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7980522808815992 X-Cell 0.0010251153254741158 ZDOCK 0.03844182470527934

Year

2024 0.05840407470288625 2025 1.0 2026 0.7534804753820034 2027 0.0

Keywords

target 1.0 potential 0.3164777680906713 docking 0.252615518744551 analysis 0.2109851787271142 visualization 0.17218831734960768 between 0.10483870967741936 novel 0.1015693112467306 binding 0.0972101133391456 promising 0.0937227550130776 activity 0.06756756756756757 cell 0.04380993897122929 including 0.035091543156059286 stability 0.03443766346992153 energy 0.03007846556233653 strong 0.02986050566695728 therapeutic 0.02724498692240628 development 0.023975588491717523 effective 0.016564952048823016 protein 0.015911072362685266 synthesized 0.013949433304272014 mechanism 0.008282476024411508 performance 0.006320836965998256 interaction 0.003051438535309503 enhanced 2.1795989537925023E-4 synthesis 0.0
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