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Application

Discovery Studio 1.0 Materials Studio 0.9954145267791636 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05812324929971989 Amorphous Cell 0.27941176470588236 Blends 0.0021008403361344537 CASTEP 0.3536414565826331 CDOCKER 0.16666666666666666 CHARMm 0.25396825396825395 COMPASS 0.3527077497665733 COMPASS III 0.10130718954248366 COSMObase 0.004435107376283847 COSMOconf 0.006069094304388422 COSMOmic 2.3342670401493932E-4 COSMOperm 0.0011671335200746965 COSMOplex 2.3342670401493932E-4 COSMOquick 9.337068160597573E-4 COSMOtherm 0.06699346405228758 Catalyst 0.10457516339869281 Classical Simulations 1.0 Conformers 4.6685340802987864E-4 Crystallization 0.07329598506069095 DFTB Plus 0.006069094304388422 DMol3 0.16106442577030813 DPD 0.0028011204481792717 Discover 0.003034547152194211 Forcite 0.5394491129785247 GULP 0.02100840336134454 Kinetix 2.3342670401493932E-4 LUDI 0.0025676937441643324 LibDock 0.0688608776844071 LigandFit 0.003968253968253968 MODELER 0.22642390289449113 MesoDyn 2.3342670401493932E-4 Mesocite 0.0025676937441643324 Mesoscale 0.0056022408963585435 Modules 0.0 Morphology 0.017973856209150325 ONETEP 0.0014005602240896359 Polymorph 0.0021008403361344537 QMERA 0.0 QSAR 4.6685340802987864E-4 Quantum Mechanics 0.5051353874883286 Reflex 0.05182072829131653 Reflex Plus 0.0014005602240896359 Semi-empirical 0.007236227824463119 Sorption 0.06162464985994398 Synthia 0.0021008403361344537 TURBOMOLE 2.3342670401493932E-4 VAMP 7.002801120448179E-4 Visualization 0.7906162464985994 X-Cell 7.002801120448179E-4 ZDOCK 0.02661064425770308

Year

2023 0.15734024179620035 2024 0.41968911917098445 2025 1.0 2026 0.4473229706390328 2027 0.0

Keywords

target 1.0 potential 0.29627670827163105 docking 0.22276285170298288 analysis 0.20763697905648404 visualization 0.19441506240744658 between 0.14924899513433468 novel 0.10027501586629999 energy 0.08599534588533954 promising 0.07785064522953247 binding 0.07245610323672519 cell 0.06536915591284112 activity 0.059234186587687754 stability 0.03924264861434314 performance 0.03617516395176645 synthesized 0.03321345462238206 interaction 0.02633805796488259 including 0.022635921303152104 mechanism 0.022001269303998306 experimental 0.021789718637613708 development 0.02136661730484451 effective 0.018404907975460124 synthesis 0.008673577321768563 protein 0.008567801988576264 enhanced 0.0037021366617304846 design 0.0
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