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Application

Discovery Studio 0.927511691662635 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0683695652173913 Amorphous Cell 0.285 Blends 0.0033695652173913043 CASTEP 0.41141304347826085 CDOCKER 0.16641304347826086 CHARMm 0.24358695652173912 COMPASS 0.37967391304347825 COMPASS III 0.07641304347826088 COSMObase 0.0031521739130434784 COSMOconf 0.004130434782608695 COSMOmic 1.0869565217391305E-4 COSMOperm 0.0010869565217391304 COSMOplex 4.347826086956522E-4 COSMOquick 0.0013043478260869566 COSMOtherm 0.06847826086956521 Cantera 0.0 Catalyst 0.10717391304347826 Classical Simulations 1.0 Conformers 0.0014130434782608696 Crystallization 0.07652173913043478 DFTB Plus 0.00608695652173913 DMol3 0.18956521739130436 DPD 0.0033695652173913043 Discover 0.005869565217391304 Forcite 0.5454347826086956 GULP 0.02467391304347826 Kinetix 2.173913043478261E-4 LUDI 0.005652173913043478 LibDock 0.06543478260869565 LigandFit 0.007173913043478261 MCSS 0.0010869565217391304 MODELER 0.1933695652173913 MesoDyn 0.0013043478260869566 Mesocite 0.004891304347826087 Mesoscale 0.008478260869565218 Morphology 0.017826086956521738 ONETEP 0.0013043478260869566 Polymorph 0.002282608695652174 QMERA 2.173913043478261E-4 QSAR 0.0015217391304347826 Quantum Mechanics 0.5894565217391304 Reflex 0.05565217391304348 Reflex Plus 5.434782608695652E-4 Semi-empirical 0.007934782608695653 Sorption 0.05326086956521739 Synthia 0.0010869565217391304 TURBOMOLE 5.434782608695652E-4 VAMP 0.0014130434782608696 Visualization 0.8053260869565217 X-Cell 0.0011956521739130434 ZDOCK 0.029347826086956522

Year

2020 0.031309418177208774 2021 0.1886170617315249 2022 0.22030675624286983 2023 0.5060210419571556 2024 0.8002281658004817 2025 1.0 2026 0.5198377487641019 2027 0.0

Keywords

target 1.0 potential 0.25413734068860566 docking 0.19783146281148944 visualization 0.18908122503328895 analysis 0.17695453680806544 between 0.151797603195739 novel 0.09097393950922579 energy 0.08441126117557542 cell 0.06125166444740346 binding 0.061013886246908886 promising 0.04712763933802549 activity 0.04560585885486019 interaction 0.02953205250142667 experimental 0.028152938938558112 stability 0.026440935894997148 synthesized 0.024205820810348107 performance 0.01759558683659882 mechanism 0.01616891763363135 effective 0.014219136389575804 development 0.011508464903937607 including 0.006657789613848202 protein 0.005754232451968803 synthesis 0.004850675290089404 chemical 8.560015217804832E-4 design 0.0
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