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Application

Discovery Studio 0.9365175594335946 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07040902003118628 Amorphous Cell 0.2770181120307065 Antibody 3.598416696653472E-4 Blends 0.0032385750269881253 CASTEP 0.439906441165887 CDOCKER 0.17488305145735877 CHARMm 0.24745112150653711 COMPASS 0.3846107712606453 COMPASS III 0.0634520810843229 COSMObase 0.0024589180760465393 COSMOconf 0.0030586541921554518 COSMOmic 2.9986805805445605E-4 COSMOperm 0.0013793930670504978 COSMOplex 4.7978889288712967E-4 COSMOquick 0.0016792611251049538 COSMOtherm 0.06645076166486746 Cantera 5.997361161089121E-5 Catalyst 0.12030706489144777 Classical Simulations 1.0 Conformers 0.0017992083483267362 Crystallization 0.07862540482187837 DFTB Plus 0.006357202830754468 DMol3 0.20756866978529448 DPD 0.0036583903082643638 Discover 0.006836991723641598 Forcite 0.5353244572388149 GULP 0.03028667386350006 Kinetix 1.799208348326736E-4 LUDI 0.005877413937867338 LibDock 0.06854983807124865 LigandFit 0.010015593139018831 MCSS 0.0016792611251049538 MODELER 0.19749310303466475 MesoDyn 0.002039102794770301 Mesocite 0.005217704210147535 Mesoscale 0.009355883411299028 Modules 0.0 Morphology 0.018471872376154493 ONETEP 0.0015593139018831713 Polymorph 0.002039102794770301 QMERA 4.1981528127623844E-4 QSAR 0.0017992083483267362 Quantum Mechanics 0.6332613649994002 Reflex 0.0579944824277318 Reflex Plus 8.396305625524769E-4 Reflex QPA 0.0 Semi-empirical 0.009056015353244573 Sorption 0.05361640878013674 Synthia 0.0013793930670504978 TURBOMOLE 6.597097277198033E-4 VAMP 0.0021590500179920835 Visualization 0.8348926472352165 X-Cell 0.0012594458438287153 ZDOCK 0.029447043300947582

Year

2019 0.06715661429295489 2020 0.20383510728163542 2021 0.2612772427774962 2022 0.3580841358337557 2023 0.841611758743031 2024 1.0 2025 0.9661260348031762 2026 0.3590978205778003 2027 0.0

Keywords

target 1.0 potential 0.2331827309236948 visualization 0.19322289156626507 docking 0.19161646586345382 analysis 0.15886044176706826 between 0.15356425702811244 novel 0.0939508032128514 energy 0.08376004016064258 binding 0.0588855421686747 cell 0.0571285140562249 activity 0.04779116465863454 interaction 0.038403614457831324 promising 0.03401104417670683 experimental 0.032404618473895586 synthesized 0.026606425702811246 mechanism 0.02045682730923695 stability 0.016741967871485942 protein 0.01360441767068273 effective 0.01069277108433735 development 0.01034136546184739 performance 0.010140562248995984 synthesis 0.008835341365461847 chemical 0.00642570281124498 design 0.0027359437751004016 including 0.0
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