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Application

Discovery Studio 1.0 Materials Studio 0.9581865754251786 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06756946393488633 Amorphous Cell 0.2739966320516419 Antibody 2.1049677238282346E-4 Blends 0.0029469548133595285 CASTEP 0.4155206286836935 CDOCKER 0.18334268874543924 CHARMm 0.2639629525680606 COMPASS 0.37454392365983724 COMPASS III 0.07058658433904014 COSMObase 0.0026662924501824306 COSMOconf 0.003157451585742352 COSMOmic 2.1049677238282346E-4 COSMOperm 0.0011928150435026664 COSMOplex 3.5082795397137244E-4 COSMOquick 0.0015436429974740387 COSMOtherm 0.06385068762278978 Cantera 7.01655907942745E-5 Catalyst 0.12187763120965478 Classical Simulations 1.0 Conformers 0.0011928150435026664 Crystallization 0.07655065955655346 DFTB Plus 0.006034240808307606 DMol3 0.191973056413135 DPD 0.003157451585742352 Discover 0.0054027504911591355 Forcite 0.5273645804097671 GULP 0.026873421274207127 Kinetix 2.1049677238282346E-4 LUDI 0.006034240808307606 LibDock 0.07283188324445691 LigandFit 0.009121526803255684 MCSS 0.0016138085882683132 MODELER 0.19856862194779681 MesoDyn 0.0019646365422396855 Mesocite 0.004280101038450744 Mesoscale 0.00813920853213584 Modules 0.0 Morphology 0.01796239124333427 ONETEP 0.0011928150435026664 Polymorph 0.0018944709514454113 QMERA 3.5082795397137244E-4 QSAR 0.0016138085882683132 Quantum Mechanics 0.594583216390682 Reflex 0.05655346618018524 Reflex Plus 6.314903171484704E-4 Semi-empirical 0.008349705304518664 Sorption 0.05409767050238563 Synthia 0.0013331462250912153 TURBOMOLE 5.61324726354196E-4 VAMP 0.0018243053606511366 Visualization 0.9028206567499298 X-Cell 0.0011928150435026664 ZDOCK 0.03171484703901207

Year

2019 0.0011841326228537595 2020 0.10970142941723758 2021 0.2567030364543686 2022 0.29417237587752687 2023 0.5323521948743973 2024 1.0 2025 0.9673517719698892 2026 0.35955341283938086 2027 0.0

Keywords

target 1.0 potential 0.25325450680024464 visualization 0.21449165623088795 docking 0.2133558551999301 analysis 0.17220491015522615 between 0.14870256574540583 novel 0.09829047383289163 energy 0.07752570113871333 binding 0.06820630806418732 cell 0.05408160293560882 activity 0.051518769840114165 interaction 0.03847161953577773 promising 0.03820951160555669 synthesized 0.026123423712030754 experimental 0.025832192678451816 stability 0.02006581821358884 protein 0.019425109939715177 mechanism 0.016512799603925793 development 0.01342575064798905 effective 0.012581180650610129 synthesis 0.010950286862568076 performance 0.007863237906631331 including 0.0037568803331683026 chemical 0.00221335585519993 design 0.0
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